5-(2-chloranyl-4-nitro-phenyl)carbonyl-7,8-dihydro-6H-pyrido[3,2-b]azepin-9-one

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)carbonyl-7,8-dihydro-6H-pyrido[3,2-b]azepin-9-one Openeye Name: 5-(2-chloro-4-nitro-benzoyl)-7,8-dihydro-6H-pyrido[3,2-b]azepin-9-one CAS Name: 5-[(2-chloro-4-nitrophenyl)-oxomethyl]-7,8-dihydro-6H-pyrido[3,2-b]azepin-9-one IUPAC Name: 5-(2-chloro-4-nitrobenzoyl)-7,8-dihydro-6H-pyrido[3,2-b]azepin-9-one Traditional Name: 5-(2-chloro-4-nitro-benzoyl)-7,8-dihydro-6H-pyrid[3,2-b]azepin-9-one Formula: C16H12ClN3O4 MolecularWeight: 345.73718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C(C=CC=N2)N(C1)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC(=O)C2=C(C=CC=N2)N(C1)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12ClN3O4/c17-12-9-10(20(23)24)5-6-11(12)16(22)19-8-2-4-14(21)15-13(19)3-1-7-18-15/h1,3,5-7,9H,2,4,8H2