ethyl 3-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(4-methoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(4-methoxyphenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-3-[(2-chloropyridine-3-carbonyl)amino]-4-(4-methoxyphenyl)pyrrole-2-carboxylate CAS Name: 3-[[(2-chloro-3-pyridinyl)-oxomethyl]amino]-4-(4-methoxyphenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-[(2-chloropyridine-3-carbonyl)amino]-4-(4-methoxyphenyl)pyrrole-2-carboxylate Traditional Name: 1-benzyl-3-[(2-chloronicotinoyl)amino]-4-(4-methoxyphenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C27H24ClN3O4 MolecularWeight: 489.95016

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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)C4=C(N=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H24ClN3O4/c1-3-35-27(33)24-23(30-26(32)21-10-7-15-29-25(21)28)22(19-11-13-20(34-2)14-12-19)17-31(24)16-18-8-5-4-6-9-18/h4-15,17H,3,16H2,1-2H3,(H,30,32)