ethyl 1-[(4-methylphenyl)carbamoylamino]-6-(trifluoromethyl)indole-3-carboxylate

Systemtic Name: ethyl 1-[(4-methylphenyl)carbamoylamino]-6-(trifluoromethyl)indole-3-carboxylate Openeye Name: ethyl 1-(p-tolylcarbamoylamino)-6-(trifluoromethyl)indole-3-carboxylate CAS Name: 1-[[(4-methylanilino)-oxomethyl]amino]-6-(trifluoromethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-methylphenyl)carbamoylamino]-6-(trifluoromethyl)indole-3-carboxylate Traditional Name: 1-(p-tolylcarbamoylamino)-6-(trifluoromethyl)indole-3-carboxylic acid ethyl ester Formula: C20H18F3N3O3 MolecularWeight: 405.37043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C1C=CC(=C2)C(F)(F)F)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C1C=CC(=C2)C(F)(F)F)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H18F3N3O3/c1-3-29-18(27)16-11-26(17-10-13(20(21,22)23)6-9-15(16)17)25-19(28)24-14-7-4-12(2)5-8-14/h4-11H,3H2,1-2H3,(H2,24,25,28)