9-chloranyl-N-(4-cyanophenyl)-3-oxidanylidene-4,5-dihydro-1,4-benzoxazepine-5-carboxamide

Systemtic Name: 9-chloranyl-N-(4-cyanophenyl)-3-oxidanylidene-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Openeye Name: 9-chloro-N-(4-cyanophenyl)-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide CAS Name: 9-chloro-N-(4-cyanophenyl)-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide IUPAC Name: 9-chloro-N-(4-cyanophenyl)-3-oxo-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Traditional Name: 9-chloro-N-(4-cyanophenyl)-3-keto-4,5-dihydro-1,4-benzoxazepine-5-carboxamide Formula: C17H12ClN3O3 MolecularWeight: 341.74848

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC(C2=C(O1)C(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1C(=O)NC(C2=C(O1)C(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12ClN3O3/c18-13-3-1-2-12-15(21-14(22)9-24-16(12)13)17(23)20-11-6-4-10(8-19)5-7-11/h1-7,15H,9H2,(H,20,23)(H,21,22)