methyl (E)-4-oxidanylidene-4-[(1-phenethylpiperidin-4-yl)-phenyl-amino]but-2-enoate

Systemtic Name: methyl (E)-4-oxidanylidene-4-[(1-phenethylpiperidin-4-yl)-phenyl-amino]but-2-enoate Openeye Name: methyl (E)-4-oxo-4-(N-(1-phenethyl-4-piperidyl)anilino)but-2-enoate CAS Name: (E)-4-oxo-4-(N-(1-phenethyl-4-piperidinyl)anilino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-oxo-4-(N-(1-phenethylpiperidin-4-yl)anilino)but-2-enoate Traditional Name: (E)-4-keto-4-(N-(1-phenethyl-4-piperidyl)anilino)but-2-enoic acid methyl ester Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)/C=C/C(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H28N2O3/c1-29-24(28)13-12-23(27)26(21-10-6-3-7-11-21)22-15-18-25(19-16-22)17-14-20-8-4-2-5-9-20/h2-13,22H,14-19H2,1H3/b13-12+