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

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-[4-(4-methoxyphenyl)piperazino]pyrrolidino]benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C30H28BrN3O6 MolecularWeight: 606.46382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3CC(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C30H28BrN3O6/c1-39-25-12-10-23(11-13-25)32-14-16-33(17-15-32)26-18-28(36)34(29(26)37)24-8-4-21(5-9-24)30(38)40-19-27(35)20-2-6-22(31)7-3-20/h2-13,26H,14-19H2,1H3