N-[[4-methoxy-3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)phenyl]methyl]-1-naphthalen-1-yl-ethanamine

Systemtic Name: N-[[4-methoxy-3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)phenyl]methyl]-1-naphthalen-1-yl-ethanamine Openeye Name: N-[[4-methoxy-3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)phenyl]methyl]-1-(1-naphthyl)ethanamine CAS Name: N-[[4-methoxy-3-(1-methyl-5-pyrrolo[2,3-b]pyridinyl)phenyl]methyl]-1-(1-naphthalenyl)ethanamine IUPAC Name: N-[[4-methoxy-3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)phenyl]methyl]-1-naphthalen-1-ylethanamine Traditional Name: [4-methoxy-3-(1-methylpyrrolo[2,3-b]pyridin-5-yl)benzyl]-[1-(1-naphthyl)ethyl]amine Formula: C28H27N3O MolecularWeight: 421.53348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NCC3=CC(=C(C=C3)OC)C4=CN=C5C(=C4)C=CN5C

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NCC3=CC(=C(C=C3)OC)C4=CN=C5C(=C4)C=CN5C

InChI

InChI=1S/C28H27N3O/c1-19(24-10-6-8-21-7-4-5-9-25(21)24)29-17-20-11-12-27(32-3)26(15-20)23-16-22-13-14-31(2)28(22)30-18-23/h4-16,18-19,29H,17H2,1-3H3