methyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-1-ethanoyl-2,4-diphenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-1-ethanoyl-2,4-diphenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-acetyl-5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate CAS Name: 1-acetyl-5-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-acetyl-5-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2,4-diphenylpyrrolidine-3-carboxylate Traditional Name: 1-acetyl-2,4-diphenyl-5-(piperonylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C29H28N2O6 MolecularWeight: 500.54242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C(C(C1C(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC(=O)N1C(C(C(C1C(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C29H28N2O6/c1-18(32)31-26(21-11-7-4-8-12-21)25(29(34)35-2)24(20-9-5-3-6-10-20)27(31)28(33)30-16-19-13-14-22-23(15-19)37-17-36-22/h3-15,24-27H,16-17H2,1-2H3,(H,30,33)