1-[4,5-bis(oxidanyl)pentyl]-6,7-dimethyl-3-phenyl-quinoxalin-2-one

Systemtic Name: 1-[4,5-bis(oxidanyl)pentyl]-6,7-dimethyl-3-phenyl-quinoxalin-2-one Openeye Name: 1-(4,5-dihydroxypentyl)-6,7-dimethyl-3-phenyl-quinoxalin-2-one CAS Name: 1-(4,5-dihydroxypentyl)-6,7-dimethyl-3-phenyl-2-quinoxalinone IUPAC Name: 1-(4,5-dihydroxypentyl)-6,7-dimethyl-3-phenylquinoxalin-2-one Traditional Name: 1-(4,5-dihydroxypentyl)-6,7-dimethyl-3-phenyl-quinoxalin-2-one Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=O)C(=N2)C3=CC=CC=C3)CCCC(CO)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=O)C(=N2)C3=CC=CC=C3)CCCC(CO)O

InChI

InChI=1S/C21H24N2O3/c1-14-11-18-19(12-15(14)2)23(10-6-9-17(25)13-24)21(26)20(22-18)16-7-4-3-5-8-16/h3-5,7-8,11-12,17,24-25H,6,9-10,13H2,1-2H3