O1-methyl O4-[1-[[2-(phenylcarbonyl)phenyl]methyl]piperidin-4-yl] (E)-but-2-enedioate

Systemtic Name: O1-methyl O4-[1-[[2-(phenylcarbonyl)phenyl]methyl]piperidin-4-yl] (E)-but-2-enedioate Openeye Name: O4-[1-[(2-benzoylphenyl)methyl]-4-piperidyl] O1-methyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[1-[(2-benzoylphenyl)methyl]-4-piperidinyl] ester O1-methyl ester IUPAC Name: 4-O-[1-[(2-benzoylphenyl)methyl]piperidin-4-yl] 1-O-methyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[1-(2-benzoylbenzyl)-4-piperidyl] ester O1-methyl ester Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)OC1CCN(CC1)CC2=CC=CC=C2C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)/C=C/C(=O)OC1CCN(CC1)CC2=CC=CC=C2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H25NO5/c1-29-22(26)11-12-23(27)30-20-13-15-25(16-14-20)17-19-9-5-6-10-21(19)24(28)18-7-3-2-4-8-18/h2-12,20H,13-17H2,1H3/b12-11+