1-[[7-bromanyl-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-6-yl]methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[[7-bromanyl-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-6-yl]methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(7-bromo-2,3-dioxo-1,4-dihydroquinoxalin-6-yl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(7-bromo-2,3-dioxo-1,4-dihydroquinoxalin-6-yl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(7-bromo-2,3-dioxo-1,4-dihydroquinoxalin-6-yl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(7-bromo-2,3-diketo-1,4-dihydroquinoxalin-6-yl)methyl]pipecolinic acid Formula: C15H16BrN3O4 MolecularWeight: 382.20924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)CC2=CC3=C(C=C2Br)NC(=O)C(=O)N3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)CC2=CC3=C(C=C2Br)NC(=O)C(=O)N3

InChI

InChI=1S/C15H16BrN3O4/c16-9-6-11-10(17-13(20)14(21)18-11)5-8(9)7-19-4-2-1-3-12(19)15(22)23/h5-6,12H,1-4,7H2,(H,17,20)(H,18,21)(H,22,23)