N-[[4-(aminomethyl)phenyl]methyl]-2-(5-bromanyl-1H-indol-3-yl)-6-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(5-bromanyl-1H-indol-3-yl)-6-phenyl-quinoline-4-carboxamide Openeye Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-phenyl-quinoline-4-carboxamide CAS Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-phenyl-4-quinolinecarboxamide IUPAC Name: N-[[4-(aminomethyl)phenyl]methyl]-2-(5-bromo-1H-indol-3-yl)-6-phenylquinoline-4-carboxamide Traditional Name: N-[4-(aminomethyl)benzyl]-2-(5-bromo-1H-indol-3-yl)-6-phenyl-cinchoninamide Formula: C32H25BrN4O MolecularWeight: 561.4711

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCC4=CC=C(C=C4)CN)C5=CNC6=C5C=C(C=C6)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCC4=CC=C(C=C4)CN)C5=CNC6=C5C=C(C=C6)Br

InChI

InChI=1S/C32H25BrN4O/c33-24-11-13-29-26(15-24)28(19-35-29)31-16-27(32(38)36-18-21-8-6-20(17-34)7-9-21)25-14-23(10-12-30(25)37-31)22-4-2-1-3-5-22/h1-16,19,35H,17-18,34H2,(H,36,38)