(phenylmethyl) 2,5-dimethyl-1-[2-(phenylmethoxycarbonylamino)ethyl]pyrrole-3-carboxylate

Systemtic Name: (phenylmethyl) 2,5-dimethyl-1-[2-(phenylmethoxycarbonylamino)ethyl]pyrrole-3-carboxylate Openeye Name: benzyl 1-[2-(benzyloxycarbonylamino)ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[2-(phenylmethoxycarbonylamino)ethyl]-3-pyrrolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2,5-dimethyl-1-[2-(phenylmethoxycarbonylamino)ethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-(benzyloxycarbonylamino)ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid benzyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCNC(=O)OCC2=CC=CC=C2)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CCNC(=O)OCC2=CC=CC=C2)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4/c1-18-15-22(23(27)29-16-20-9-5-3-6-10-20)19(2)26(18)14-13-25-24(28)30-17-21-11-7-4-8-12-21/h3-12,15H,13-14,16-17H2,1-2H3,(H,25,28)