5-methyl-8-(2-methylphenoxy)-6-(trifluoromethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-2-carboxylic acid

Systemtic Name: 5-methyl-8-(2-methylphenoxy)-6-(trifluoromethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-2-carboxylic acid Openeye Name: 5-methyl-8-(2-methylphenoxy)-6-(trifluoromethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-2-carboxylic acid CAS Name: 5-methyl-8-(2-methylphenoxy)-6-(trifluoromethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-2-carboxylic acid IUPAC Name: 5-methyl-8-(2-methylphenoxy)-6-(trifluoromethyl)-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indole-2-carboxylic acid Traditional Name: 5-methyl-8-(2-methylphenoxy)-6-(trifluoromethyl)-3,4,4a,9b-tetrahydro-1H-pyrid[4,3-b]indole-2-carboxylic acid Formula: C21H21F3N2O3 MolecularWeight: 406.39825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=C3C(=C2)C4CN(CCC4N3C)C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=C3C(=C2)C4CN(CCC4N3C)C(=O)O)C(F)(F)F

InChI

InChI=1S/C21H21F3N2O3/c1-12-5-3-4-6-18(12)29-13-9-14-15-11-26(20(27)28)8-7-17(15)25(2)19(14)16(10-13)21(22,23)24/h3-6,9-10,15,17H,7-8,11H2,1-2H3,(H,27,28)