1-[1-(dimethylamino)-2-methyl-propyl]-3-(5-phenylpyridin-3-yl)indole-4-carboxylic acid

Systemtic Name: 1-[1-(dimethylamino)-2-methyl-propyl]-3-(5-phenylpyridin-3-yl)indole-4-carboxylic acid Openeye Name: 1-[1-(dimethylamino)-2-methyl-propyl]-3-(5-phenyl-3-pyridyl)indole-4-carboxylic acid CAS Name: 1-[1-(dimethylamino)-2-methylpropyl]-3-(5-phenyl-3-pyridinyl)-4-indolecarboxylic acid IUPAC Name: 1-[1-(dimethylamino)-2-methylpropyl]-3-(5-phenylpyridin-3-yl)indole-4-carboxylic acid Traditional Name: 1-[1-(dimethylamino)-2-methyl-propyl]-3-(5-phenyl-3-pyridyl)indole-4-carboxylic acid Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(N1C=C(C2=C(C=CC=C21)C(=O)O)C3=CN=CC(=C3)C4=CC=CC=C4)N(C)C

Isomeric SMILES

CC(C)C(N1C=C(C2=C(C=CC=C21)C(=O)O)C3=CN=CC(=C3)C4=CC=CC=C4)N(C)C

InChI

InChI=1S/C26H27N3O2/c1-17(2)25(28(3)4)29-16-22(24-21(26(30)31)11-8-12-23(24)29)20-13-19(14-27-15-20)18-9-6-5-7-10-18/h5-17,25H,1-4H3,(H,30,31)