ethyl (E)-4-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[2-(4-benzhydrylpiperazine-1-carbonyl)anilino]-4-oxo-but-2-enoate CAS Name: (E)-4-[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]anilino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[2-(4-benzhydrylpiperazine-1-carbonyl)anilino]-4-oxobut-2-enoate Traditional Name: (E)-4-[2-(4-benzhydrylpiperazine-1-carbonyl)anilino]-4-keto-but-2-enoic acid ethyl ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)NC1=CC=CC=C1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)/C=C/C(=O)NC1=CC=CC=C1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H31N3O4/c1-2-37-28(35)18-17-27(34)31-26-16-10-9-15-25(26)30(36)33-21-19-32(20-22-33)29(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-18,29H,2,19-22H2,1H3,(H,31,34)/b18-17+