methyl (Z)-3-[(3-chlorophenyl)amino]-4-(cyclohexylamino)-4-oxidanylidene-but-2-enoate

Systemtic Name: methyl (Z)-3-[(3-chlorophenyl)amino]-4-(cyclohexylamino)-4-oxidanylidene-but-2-enoate Openeye Name: methyl (Z)-3-(3-chloroanilino)-4-(cyclohexylamino)-4-oxo-but-2-enoate CAS Name: (Z)-3-(3-chloroanilino)-4-(cyclohexylamino)-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3-chloroanilino)-4-(cyclohexylamino)-4-oxobut-2-enoate Traditional Name: (Z)-3-(3-chloroanilino)-4-(cyclohexylamino)-4-keto-but-2-enoic acid methyl ester Formula: C17H21ClN2O3 MolecularWeight: 336.81324

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)NC1CCCCC1)NC2=CC(=CC=C2)Cl

Isomeric SMILES

COC(=O)/C=C(/C(=O)NC1CCCCC1)\NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H21ClN2O3/c1-23-16(21)11-15(19-14-9-5-6-12(18)10-14)17(22)20-13-7-3-2-4-8-13/h5-6,9-11,13,19H,2-4,7-8H2,1H3,(H,20,22)/b15-11-