8-chloranyl-5-oxidanylidene-N-pyridin-2-yl-3,4-dihydro-2H-1-benzoxepine-4-carboxamide

Systemtic Name: 8-chloranyl-5-oxidanylidene-N-pyridin-2-yl-3,4-dihydro-2H-1-benzoxepine-4-carboxamide Openeye Name: 8-chloro-5-oxo-N-(2-pyridyl)-3,4-dihydro-2H-1-benzoxepine-4-carboxamide CAS Name: 8-chloro-5-oxo-N-(2-pyridinyl)-3,4-dihydro-2H-1-benzoxepin-4-carboxamide IUPAC Name: 8-chloro-5-oxo-N-pyridin-2-yl-3,4-dihydro-2H-1-benzoxepine-4-carboxamide Traditional Name: 8-chloro-5-keto-N-(2-pyridyl)-3,4-dihydro-2H-1-benzoxepin-4-carboxamide Formula: C16H13ClN2O3 MolecularWeight: 316.73902

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC(=C2)Cl)C(=O)C1C(=O)NC3=CC=CC=N3

Isomeric SMILES

C1COC2=C(C=CC(=C2)Cl)C(=O)C1C(=O)NC3=CC=CC=N3

InChI

InChI=1S/C16H13ClN2O3/c17-10-4-5-11-13(9-10)22-8-6-12(15(11)20)16(21)19-14-3-1-2-7-18-14/h1-5,7,9,12H,6,8H2,(H,18,19,21)