methyl 2-[[3-(trifluoromethyl)phenyl]amino]-1H-indole-3-carboxylate

Systemtic Name: methyl 2-[[3-(trifluoromethyl)phenyl]amino]-1H-indole-3-carboxylate Openeye Name: methyl 2-[3-(trifluoromethyl)anilino]-1H-indole-3-carboxylate CAS Name: 2-[3-(trifluoromethyl)anilino]-1H-indole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[3-(trifluoromethyl)anilino]-1H-indole-3-carboxylate Traditional Name: 2-[3-(trifluoromethyl)anilino]-1H-indole-3-carboxylic acid methyl ester Formula: C17H13F3N2O2 MolecularWeight: 334.29253

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC2=CC=CC=C21)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(NC2=CC=CC=C21)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H13F3N2O2/c1-24-16(23)14-12-7-2-3-8-13(12)22-15(14)21-11-6-4-5-10(9-11)17(18,19)20/h2-9,21-22H,1H3