1-ethyl-5-(2-fluorophenyl)-7-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-ethyl-5-(2-fluorophenyl)-7-[(E)-C-methyl-N-oxidanyl-carbonimidoyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 1-ethyl-5-(2-fluorophenyl)-7-[(E)-N-hydroxy-C-methyl-carbonimidoyl]-3H-1,4-benzodiazepin-2-one CAS Name: 1-ethyl-5-(2-fluorophenyl)-7-[(1E)-1-hydroxyiminoethyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-ethyl-5-(2-fluorophenyl)-7-[(E)-N-hydroxy-C-methylcarbonimidoyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 7-acetohydroximoyl-1-ethyl-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one Formula: C19H18FN3O2 MolecularWeight: 339.363523

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)CN=C(C2=C1C=CC(=C2)C(=NO)C)C3=CC=CC=C3F

Isomeric SMILES

CCN1C(=O)CN=C(C2=C1C=CC(=C2)/C(=N/O)/C)C3=CC=CC=C3F

InChI

InChI=1S/C19H18FN3O2/c1-3-23-17-9-8-13(12(2)22-25)10-15(17)19(21-11-18(23)24)14-6-4-5-7-16(14)20/h4-10,25H,3,11H2,1-2H3/b22-12+