N-(3,3-diphenylpropyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide

Systemtic Name: N-(3,3-diphenylpropyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Openeye Name: N-(3,3-diphenylpropyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide CAS Name: N-(3,3-diphenylpropyl)-6-methyl-2-(1-methyl-2-pyrrolyl)-4-quinolinecarboxamide IUPAC Name: N-(3,3-diphenylpropyl)-6-methyl-2-(1-methylpyrrol-2-yl)quinoline-4-carboxamide Traditional Name: N-(3,3-diphenylpropyl)-6-methyl-2-(1-methylpyrrol-2-yl)cinchoninamide Formula: C31H29N3O MolecularWeight: 459.58146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H29N3O/c1-22-15-16-28-26(20-22)27(21-29(33-28)30-14-9-19-34(30)2)31(35)32-18-17-25(23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-16,19-21,25H,17-18H2,1-2H3,(H,32,35)