(phenylmethyl) 3-ethyl-5-[(4-ethyl-3-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-4-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 3-ethyl-5-[(4-ethyl-3-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-4-methyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-[(5-benzyloxycarbonyl-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylate CAS Name: 3-ethyl-5-[(4-ethyl-3-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-4-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-ethyl-5-[(4-ethyl-3-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-4-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-[(5-carbobenzoxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)CC2=C(C(=C(N2)C(=O)OCC3=CC=CC=C3)CC)C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(NC(=C1C)CC2=C(C(=C(N2)C(=O)OCC3=CC=CC=C3)CC)C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H34N2O4/c1-5-24-20(3)26(32-28(24)30(34)36-18-22-13-9-7-10-14-22)17-27-21(4)25(6-2)29(33-27)31(35)37-19-23-15-11-8-12-16-23/h7-16,32-33H,5-6,17-19H2,1-4H3