N-[[1-(2-chlorophenyl)-2-oxidanylidene-8-(trifluoromethyl)-3H-1,5-benzodiazepin-4-yl]amino]carbamate

Systemtic Name: N-[[1-(2-chlorophenyl)-2-oxidanylidene-8-(trifluoromethyl)-3H-1,5-benzodiazepin-4-yl]amino]carbamate Openeye Name: N-[[1-(2-chlorophenyl)-2-oxo-8-(trifluoromethyl)-3H-1,5-benzodiazepin-4-yl]amino]carbamate CAS Name: N-[[1-(2-chlorophenyl)-2-oxo-8-(trifluoromethyl)-3H-1,5-benzodiazepin-4-yl]amino]carbamate IUPAC Name: N-[[1-(2-chlorophenyl)-2-oxo-8-(trifluoromethyl)-3H-1,5-benzodiazepin-4-yl]amino]carbamate Traditional Name: N-[[1-(2-chlorophenyl)-2-keto-8-(trifluoromethyl)-3H-1,5-benzodiazepin-4-yl]amino]carbamate Formula: C17H11ClF3N4O3- MolecularWeight: 411.74245

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)N(C1=O)C3=CC=CC=C3Cl)NNC(=O)[O-]

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)N(C1=O)C3=CC=CC=C3Cl)NNC(=O)[O-]

InChI

InChI=1S/C17H12ClF3N4O3/c18-10-3-1-2-4-12(10)25-13-7-9(17(19,20)21)5-6-11(13)22-14(8-15(25)26)23-24-16(27)28/h1-7,24H,8H2,(H,22,23)(H,27,28)/p-1