(2-oxidanylideneazepan-3-yl) 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: (2-oxoazepan-3-yl) 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid (2-ketoazepan-3-yl) ester Formula: C17H19N3O3 MolecularWeight: 313.35106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OC3CCCCNC3=O)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)OC3CCCCNC3=O)N=C1C

InChI

InChI=1S/C17H19N3O3/c1-10-11(2)20-14-9-12(6-7-13(14)19-10)17(22)23-15-5-3-4-8-18-16(15)21/h6-7,9,15H,3-5,8H2,1-2H3,(H,18,21)