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

Systemtic Name: (phenylmethyl) 1-(3-acetamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: benzyl 1-(3-acetamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(3-acetamidopropyl)-2,5-dimethyl-3-pyrrolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(3-acetamidopropyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(3-acetamidopropyl)-2,5-dimethyl-pyrrole-3-carboxylic acid benzyl ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCNC(=O)C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(N1CCCNC(=O)C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2O3/c1-14-12-18(15(2)21(14)11-7-10-20-16(3)22)19(23)24-13-17-8-5-4-6-9-17/h4-6,8-9,12H,7,10-11,13H2,1-3H3,(H,20,22)