N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-pyrrol-2-yl]-3-methoxy-benzamide

Systemtic Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-pyrrol-2-yl]-3-methoxy-benzamide Openeye Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-pyrrol-2-yl]-3-methoxy-benzamide CAS Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-2-pyrrolyl]-3-methoxybenzamide IUPAC Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenylpyrrol-2-yl]-3-methoxybenzamide Traditional Name: N-(3-cyano-1-p-anisyl-4,5-diphenyl-pyrrol-2-yl)-3-methoxy-benzamide Formula: C33H27N3O3 MolecularWeight: 513.58578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)C3=CC(=CC=C3)OC)C#N)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)C3=CC(=CC=C3)OC)C#N)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H27N3O3/c1-38-27-18-16-23(17-19-27)22-36-31(25-12-7-4-8-13-25)30(24-10-5-3-6-11-24)29(21-34)32(36)35-33(37)26-14-9-15-28(20-26)39-2/h3-20H,22H2,1-2H3,(H,35,37)