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Details

Stereochemistry ACHIRAL
Molecular Formula C19H16N2.ClH
Molecular Weight 308.805
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzenamine, 4-[(4-imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]-, monohydrochloride

SMILES

Cl.NC1=CC=C(C=C1)C(C2=CC=CC=C2)=C3C=CC(=N)C=C3

InChI

InChIKey=SPJSTBGXLCMAJN-QJIBKQHFSA-N
InChI=1S/C19H16N2.ClH/c20-17-10-6-15(7-11-17)19(14-4-2-1-3-5-14)16-8-12-18(21)13-9-16;/h1-13,20H,21H2;1H/b19-15-,20-17?;

HIDE SMILES / InChI

Molecular Formula C19H16N2
Molecular Weight 272.3437
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:59:25 GMT 2023
Edited
by admin
on Sat Dec 16 11:59:25 GMT 2023
Record UNII
Z8WYE573RL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenamine, 4-[(4-imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]-, monohydrochloride
Systematic Name English
Benzenamine, 4-[(4-imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]-, hydrochloride (1:1)
Systematic Name English
Benzenamine, 4-[(4-imino-2,5-cyclohexadien-1-ylidene)phenylmethyl]-, hydrochloride
Common Name English
Code System Code Type Description
FDA UNII
Z8WYE573RL
Created by admin on Sat Dec 16 11:59:25 GMT 2023 , Edited by admin on Sat Dec 16 11:59:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
222-353-1
Created by admin on Sat Dec 16 11:59:25 GMT 2023 , Edited by admin on Sat Dec 16 11:59:25 GMT 2023
PRIMARY
CAS
3442-83-9
Created by admin on Sat Dec 16 11:59:25 GMT 2023 , Edited by admin on Sat Dec 16 11:59:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID9063031
Created by admin on Sat Dec 16 11:59:25 GMT 2023 , Edited by admin on Sat Dec 16 11:59:25 GMT 2023
PRIMARY