(phenylmethyl) 1-(2-benzamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: (phenylmethyl) 1-(2-benzamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: benzyl 1-(2-benzamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(2-benzamidopropyl)-2,5-dimethyl-3-pyrrolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(2-benzamidopropyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(2-benzamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylic acid benzyl ester Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(C)NC(=O)C2=CC=CC=C2)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CC(C)NC(=O)C2=CC=CC=C2)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O3/c1-17(25-23(27)21-12-8-5-9-13-21)15-26-18(2)14-22(19(26)3)24(28)29-16-20-10-6-4-7-11-20/h4-14,17H,15-16H2,1-3H3,(H,25,27)