ethyl 3-(cyclopentylcarbonylamino)-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3-(cyclopentylcarbonylamino)-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-3-(cyclopentanecarbonylamino)-4-(3,4-dimethoxyphenyl)pyrrole-2-carboxylate CAS Name: 3-[[cyclopentyl(oxo)methyl]amino]-4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-(cyclopentanecarbonylamino)-4-(3,4-dimethoxyphenyl)pyrrole-2-carboxylate Traditional Name: 1-benzyl-3-(cyclopentanecarbonylamino)-4-(3,4-dimethoxyphenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC)NC(=O)C4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC)NC(=O)C4CCCC4

InChI

InChI=1S/C28H32N2O5/c1-4-35-28(32)26-25(29-27(31)20-12-8-9-13-20)22(18-30(26)17-19-10-6-5-7-11-19)21-14-15-23(33-2)24(16-21)34-3/h5-7,10-11,14-16,18,20H,4,8-9,12-13,17H2,1-3H3,(H,29,31)