phenacyl 4-[2,5-bis(oxidanylidene)-3-[(phenylmethyl)amino]pyrrolidin-1-yl]benzoate

Systemtic Name: phenacyl 4-[2,5-bis(oxidanylidene)-3-[(phenylmethyl)amino]pyrrolidin-1-yl]benzoate Openeye Name: phenacyl 4-[3-(benzylamino)-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[2,5-dioxo-3-[(phenylmethyl)amino]-1-pyrrolidinyl]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[3-(benzylamino)-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-(benzylamino)-2,5-diketo-pyrrolidino]benzoic acid phenacyl ester Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C26H22N2O5/c29-23(19-9-5-2-6-10-19)17-33-26(32)20-11-13-21(14-12-20)28-24(30)15-22(25(28)31)27-16-18-7-3-1-4-8-18/h1-14,22,27H,15-17H2