BUCAINIDE MALEATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H35N3.2C4H4O4
Molecular Weight	561.667
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CCCCCCN1CCN(CC1)C(=NCC(C)C)C2=CC=CC=C2

InChI

InChIKey=LPPPOISTYYZBNM-SPIKMXEPSA-N

InChI=1S/C21H35N3.2C4H4O4/c1-4-5-6-10-13-23-14-16-24(17-15-23)21(22-18-19(2)3)20-11-8-7-9-12-20;2*5-3(6)1-2-4(7)8/h7-9,11-12,19H,4-6,10,13-18H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

HIDE SMILES / InChI

Molecular Formula	C21H35N3
Molecular Weight	329.5227
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:14:29 UTC 2023` Edited by `admin` on `Fri Dec 15 15:14:29 UTC 2023`
Record UNII	IX4JNV8N0F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUCAINIDE MALEATE

Official Name

English

BUCAINIDE MALEATE [USAN]

Common Name

English

1-Hexyl-4-(N-isobutylbenzimidoyl)piperazine maleate (1:2)

Systematic Name

English

PIPERAZINE, 1-HEXYL-4-(((2-METHYLPROPYL)IMINO)PHENYLMETHYL)-, (Z)-2-BUTENEDIOATE (1:2)

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C47793