N-(1,2-diphenylethyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide

Systemtic Name: N-(1,2-diphenylethyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Openeye Name: N-(1,2-diphenylethyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide CAS Name: N-(1,2-diphenylethyl)-6-methyl-2-(1-methyl-2-pyrrolyl)-4-quinolinecarboxamide IUPAC Name: N-(1,2-diphenylethyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Traditional Name: N-(1,2-diphenylethyl)-6-methyl-2-(1-methylpyrrol-2-yl)cinchoninamide Formula: C30H27N3O MolecularWeight: 445.55488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CN5C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC(CC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CN5C

InChI

InChI=1S/C30H27N3O/c1-21-15-16-26-24(18-21)25(20-28(31-26)29-14-9-17-33(29)2)30(34)32-27(23-12-7-4-8-13-23)19-22-10-5-3-6-11-22/h3-18,20,27H,19H2,1-2H3,(H,32,34)