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

Systemtic Name: 1-[1-(dimethylamino)-2-methyl-propyl]-3-[5-(3-methoxyphenyl)pyridin-3-yl]indole-4-carboxylic acid Openeye Name: 1-[1-(dimethylamino)-2-methyl-propyl]-3-[5-(3-methoxyphenyl)-3-pyridyl]indole-4-carboxylic acid CAS Name: 1-[1-(dimethylamino)-2-methylpropyl]-3-[5-(3-methoxyphenyl)-3-pyridinyl]-4-indolecarboxylic acid IUPAC Name: 1-[1-(dimethylamino)-2-methylpropyl]-3-[5-(3-methoxyphenyl)pyridin-3-yl]indole-4-carboxylic acid Traditional Name: 1-[1-(dimethylamino)-2-methyl-propyl]-3-[5-(3-methoxyphenyl)-3-pyridyl]indole-4-carboxylic acid Formula: C27H29N3O3 MolecularWeight: 443.53746

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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)OC)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)OC)N(C)C

InChI

InChI=1S/C27H29N3O3/c1-17(2)26(29(3)4)30-16-23(25-22(27(31)32)10-7-11-24(25)30)20-12-19(14-28-15-20)18-8-6-9-21(13-18)33-5/h6-17,26H,1-5H3,(H,31,32)