[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[3-[4-(diphenylmethyl)piperazin-1-yl]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[3-[4-(diphenylmethyl)piperazin-1-yl]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 4-[3-(4-benzhydrylpiperazin-1-yl)-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[4-(diphenylmethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]benzoic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 4-[3-(4-benzhydrylpiperazin-1-yl)-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-(4-benzhydrylpiperazino)-2,5-diketo-pyrrolidino]benzoic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C37H35N3O6 MolecularWeight: 617.6903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C37H35N3O6/c1-45-31-14-8-13-29(23-31)33(41)25-46-37(44)28-15-17-30(18-16-28)40-34(42)24-32(36(40)43)38-19-21-39(22-20-38)35(26-9-4-2-5-10-26)27-11-6-3-7-12-27/h2-18,23,32,35H,19-22,24-25H2,1H3