[1-methyl-2-oxidanylidene-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid

Systemtic Name: [1-methyl-2-oxidanylidene-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid Openeye Name: [1-methyl-2-oxo-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid CAS Name: [1-methyl-2-oxo-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid IUPAC Name: [1-methyl-2-oxo-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid Traditional Name: [2-keto-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-3-yl]carbamic acid Formula: C18H14F3N3O3 MolecularWeight: 377.31727

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O3/c1-24-13-5-3-2-4-12(13)14(22-15(16(24)25)23-17(26)27)10-6-8-11(9-7-10)18(19,20)21/h2-9,15,23H,1H3,(H,26,27)