3-[[4-[(2-chlorophenyl)-[4-(2-cyanoethylimino)cyclohexa-2,5-dien-1-ylidene]methyl]phenyl]amino]propanenitrile hydrochloride

Systemtic Name: 3-[[4-[(2-chlorophenyl)-[4-(2-cyanoethylimino)cyclohexa-2,5-dien-1-ylidene]methyl]phenyl]amino]propanenitrile hydrochloride Openeye Name: 3-[4-[(2-chlorophenyl)-[4-(2-cyanoethylimino)cyclohexa-2,5-dien-1-ylidene]methyl]anilino]propanenitrile hydrochloride CAS Name: 3-[4-[(2-chlorophenyl)-[4-(2-cyanoethylimino)-1-cyclohexa-2,5-dienylidene]methyl]anilino]propanenitrile hydrochloride IUPAC Name: 3-[4-[(2-chlorophenyl)-[4-(2-cyanoethylimino)cyclohexa-2,5-dien-1-ylidene]methyl]anilino]propanenitrile hydrochloride Traditional Name: 3-[4-[(2-chlorophenyl)-[4-(2-cyanoethylimino)cyclohexa-2,5-dien-1-ylidene]methyl]anilino]propionitrile hydrochloride Formula: C25H22Cl2N4 MolecularWeight: 449.37498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=C2C=CC(=NCCC#N)C=C2)C3=CC=C(C=C3)NCCC#N)Cl.Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=C2C=CC(=NCCC#N)C=C2)C3=CC=C(C=C3)NCCC#N)Cl.Cl

InChI

InChI=1S/C25H21ClN4.ClH/c26-24-6-2-1-5-23(24)25(19-7-11-21(12-8-19)29-17-3-15-27)20-9-13-22(14-10-20)30-18-4-16-28;/h1-2,5-14,29H,3-4,17-18H2;1H