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

Systemtic Name: methyl 4-(3-cyanophenyl)-1-[(4-cyanophenyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: methyl 4-(3-cyanophenyl)-1-[(4-cyanophenyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-(3-cyanophenyl)-1-[(4-cyanophenyl)methyl]-2,5-dimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-cyanophenyl)-1-[(4-cyanophenyl)methyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-cyanobenzyl)-4-(3-cyanophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O2/c1-15-21(20-6-4-5-19(11-20)13-25)22(23(27)28-3)16(2)26(15)14-18-9-7-17(12-24)8-10-18/h4-11H,14H2,1-3H3