ethyl 3-[(2-acetyloxy-2-phenyl-ethanoyl)amino]-4-(4-methoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3-[(2-acetyloxy-2-phenyl-ethanoyl)amino]-4-(4-methoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 3-[(2-acetoxy-2-phenyl-acetyl)amino]-1-benzyl-4-(4-methoxyphenyl)pyrrole-2-carboxylate CAS Name: 3-[(2-acetyloxy-1-oxo-2-phenylethyl)amino]-4-(4-methoxyphenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-acetyloxy-2-phenylacetyl)amino]-1-benzyl-4-(4-methoxyphenyl)pyrrole-2-carboxylate Traditional Name: 3-[(2-acetoxy-2-phenyl-acetyl)amino]-1-benzyl-4-(4-methoxyphenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C31H30N2O6 MolecularWeight: 526.5797

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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)NC(=O)C(C4=CC=CC=C4)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC=C(C=C3)OC)NC(=O)C(C4=CC=CC=C4)OC(=O)C

InChI

InChI=1S/C31H30N2O6/c1-4-38-31(36)28-27(32-30(35)29(39-21(2)34)24-13-9-6-10-14-24)26(23-15-17-25(37-3)18-16-23)20-33(28)19-22-11-7-5-8-12-22/h5-18,20,29H,4,19H2,1-3H3,(H,32,35)