N3-[[5-(1H-indol-6-yl)-2-phenylmethoxy-phenyl]methyl]pyridine-2,3-diamine

Systemtic Name: N3-[[5-(1H-indol-6-yl)-2-phenylmethoxy-phenyl]methyl]pyridine-2,3-diamine Openeye Name: N3-[[2-benzyloxy-5-(1H-indol-6-yl)phenyl]methyl]pyridine-2,3-diamine CAS Name: N3-[[5-(1H-indol-6-yl)-2-phenylmethoxyphenyl]methyl]pyridine-2,3-diamine IUPAC Name: 3-N-[[5-(1H-indol-6-yl)-2-phenylmethoxyphenyl]methyl]pyridine-2,3-diamine Traditional Name: (2-amino-3-pyridyl)-[2-benzoxy-5-(1H-indol-6-yl)benzyl]amine Formula: C27H24N4O MolecularWeight: 420.50566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=CC4=C(C=C3)C=CN4)CNC5=C(N=CC=C5)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=CC4=C(C=C3)C=CN4)CNC5=C(N=CC=C5)N

InChI

InChI=1S/C27H24N4O/c28-27-24(7-4-13-30-27)31-17-23-15-21(22-9-8-20-12-14-29-25(20)16-22)10-11-26(23)32-18-19-5-2-1-3-6-19/h1-16,29,31H,17-18H2,(H2,28,30)