3-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methylphenyl)pyrrole-2-carboxamide

Systemtic Name: 3-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methylphenyl)pyrrole-2-carboxamide Openeye Name: 3-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(o-tolyl)pyrrole-2-carboxamide CAS Name: 3-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methylphenyl)-2-pyrrolecarboxamide IUPAC Name: 3-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-methylphenyl)pyrrole-2-carboxamide Traditional Name: 3-cyano-N-homoveratryl-1-(o-tolyl)pyrrole-2-carboxamide Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CC(=C2C(=O)NCCC3=CC(=C(C=C3)OC)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C=CC(=C2C(=O)NCCC3=CC(=C(C=C3)OC)OC)C#N

InChI

InChI=1S/C23H23N3O3/c1-16-6-4-5-7-19(16)26-13-11-18(15-24)22(26)23(27)25-12-10-17-8-9-20(28-2)21(14-17)29-3/h4-9,11,13-14H,10,12H2,1-3H3,(H,25,27)