N-[[4-(aminomethyl)phenyl]methyl]-2-(1-methylpyrrol-3-yl)quinoline-4-carboxamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(1-methylpyrrol-3-yl)quinoline-4-carboxamide Openeye Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(1-methylpyrrol-3-yl)quinoline-4-carboxamide CAS Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(1-methyl-3-pyrrolyl)-4-quinolinecarboxamide IUPAC Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(1-methylpyrrol-3-yl)quinoline-4-carboxamide Traditional Name: N-[4-(aminomethyl)benzyl]-2-(1-methylpyrrol-3-yl)cinchoninamide Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)CN

Isomeric SMILES

CN1C=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)CN

InChI

InChI=1S/C23H22N4O/c1-27-11-10-18(15-27)22-12-20(19-4-2-3-5-21(19)26-22)23(28)25-14-17-8-6-16(13-24)7-9-17/h2-12,15H,13-14,24H2,1H3,(H,25,28)