N-[[4-(aminomethyl)phenyl]methyl]-8-chloranyl-2-(1H-indol-3-yl)quinoline-4-carboxamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]-8-chloranyl-2-(1H-indol-3-yl)quinoline-4-carboxamide Openeye Name: N-[[4-(aminomethyl)phenyl]methyl]-8-chloro-2-(1H-indol-3-yl)quinoline-4-carboxamide CAS Name: N-[[4-(aminomethyl)phenyl]methyl]-8-chloro-2-(1H-indol-3-yl)-4-quinolinecarboxamide IUPAC Name: N-[[4-(aminomethyl)phenyl]methyl]-8-chloro-2-(1H-indol-3-yl)quinoline-4-carboxamide Traditional Name: N-[4-(aminomethyl)benzyl]-8-chloro-2-(1H-indol-3-yl)cinchoninamide Formula: C26H21ClN4O MolecularWeight: 440.92414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=NC4=C(C=CC=C4Cl)C(=C3)C(=O)NCC5=CC=C(C=C5)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=NC4=C(C=CC=C4Cl)C(=C3)C(=O)NCC5=CC=C(C=C5)CN

InChI

InChI=1S/C26H21ClN4O/c27-22-6-3-5-19-20(26(32)30-14-17-10-8-16(13-28)9-11-17)12-24(31-25(19)22)21-15-29-23-7-2-1-4-18(21)23/h1-12,15,29H,13-14,28H2,(H,30,32)