methyl 1-(3,5-dimethylphenyl)carbonyl-2-[(4-pyrrol-1-ylphenyl)methyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(3,5-dimethylphenyl)carbonyl-2-[(4-pyrrol-1-ylphenyl)methyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-(3,5-dimethylbenzoyl)-2-[(4-pyrrol-1-ylphenyl)methyl]pyrrolidine-2-carboxylate CAS Name: 1-[(3,5-dimethylphenyl)-oxomethyl]-2-[[4-(1-pyrrolyl)phenyl]methyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,5-dimethylbenzoyl)-2-[(4-pyrrol-1-ylphenyl)methyl]pyrrolidine-2-carboxylate Traditional Name: 1-(3,5-dimethylbenzoyl)-2-(4-pyrrol-1-ylbenzyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCCC2(CC3=CC=C(C=C3)N4C=CC=C4)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCCC2(CC3=CC=C(C=C3)N4C=CC=C4)C(=O)OC)C

InChI

InChI=1S/C26H28N2O3/c1-19-15-20(2)17-22(16-19)24(29)28-14-6-11-26(28,25(30)31-3)18-21-7-9-23(10-8-21)27-12-4-5-13-27/h4-5,7-10,12-13,15-17H,6,11,14,18H2,1-3H3