[2-oxidanylidene-2-[2-oxidanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl] 6-methylpyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-oxidanylidene-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl] 6-methylpyridine-3-carboxylate Openeye Name: [2-oxo-2-[2-oxo-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl] 6-methylpyridine-3-carboxylate CAS Name: 6-methyl-3-pyridinecarboxylic acid [2-oxo-2-[2-oxo-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl] ester IUPAC Name: [2-oxo-2-[2-oxo-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl] 6-methylpyridine-3-carboxylate Traditional Name: 6-methylnicotinic acid [2-keto-2-[2-keto-4-(trifluoromethyl)-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl] ester Formula: C19H16F3N3O4 MolecularWeight: 407.34325

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)OCC(=O)N2C(CC(=O)NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)OCC(=O)N2C(CC(=O)NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O4/c1-11-6-7-12(9-23-11)18(28)29-10-17(27)25-14-5-3-2-4-13(14)24-16(26)8-15(25)19(20,21)22/h2-7,9,15H,8,10H2,1H3,(H,24,26)