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

Systemtic Name: methyl (Z)-4-(cyclohexylamino)-3-[(4-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: methyl (Z)-4-(cyclohexylamino)-3-(4-methyl-3-nitro-anilino)-4-oxo-but-2-enoate CAS Name: (Z)-4-(cyclohexylamino)-3-(4-methyl-3-nitroanilino)-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-4-(cyclohexylamino)-3-(4-methyl-3-nitroanilino)-4-oxobut-2-enoate Traditional Name: (Z)-4-(cyclohexylamino)-4-keto-3-(4-methyl-3-nitro-anilino)but-2-enoic acid methyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=CC(=O)OC)C(=O)NC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N/C(=C\C(=O)OC)/C(=O)NC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5/c1-12-8-9-14(10-16(12)21(24)25)19-15(11-17(22)26-2)18(23)20-13-6-4-3-5-7-13/h8-11,13,19H,3-7H2,1-2H3,(H,20,23)/b15-11-