methyl 4-(4-cyanophenyl)-1-[(6-methoxypyridin-3-yl)methyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(4-cyanophenyl)-1-[(6-methoxypyridin-3-yl)methyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: methyl 4-(4-cyanophenyl)-1-[(6-methoxy-3-pyridyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-(4-cyanophenyl)-1-[(6-methoxy-3-pyridinyl)methyl]-2,5-dimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-cyanophenyl)-1-[(6-methoxypyridin-3-yl)methyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 4-(4-cyanophenyl)-1-[(6-methoxy-3-pyridyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CN=C(C=C2)OC)C)C(=O)OC)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CN=C(C=C2)OC)C)C(=O)OC)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H21N3O3/c1-14-20(18-8-5-16(11-23)6-9-18)21(22(26)28-4)15(2)25(14)13-17-7-10-19(27-3)24-12-17/h5-10,12H,13H2,1-4H3