N-(4-cyanophenyl)-6-fluoranyl-9-methyl-3-oxidanylidene-4,5-dihydro-1,4-benzoxazepine-5-carboxamide

Systemtic Name: N-(4-cyanophenyl)-6-fluoranyl-9-methyl-3-oxidanylidene-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Openeye Name: N-(4-cyanophenyl)-6-fluoro-9-methyl-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide CAS Name: N-(4-cyanophenyl)-6-fluoro-9-methyl-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide IUPAC Name: N-(4-cyanophenyl)-6-fluoro-9-methyl-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Traditional Name: N-(4-cyanophenyl)-6-fluoro-3-keto-9-methyl-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Formula: C18H14FN3O3 MolecularWeight: 339.320463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)F)C(NC(=O)CO2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C2C(=C(C=C1)F)C(NC(=O)CO2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H14FN3O3/c1-10-2-7-13(19)15-16(22-14(23)9-25-17(10)15)18(24)21-12-5-3-11(8-20)4-6-12/h2-7,16H,9H2,1H3,(H,21,24)(H,22,23)