7-chloranyl-8-methyl-10-[2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridine-2,4-dione

Systemtic Name: 7-chloranyl-8-methyl-10-[2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridine-2,4-dione Openeye Name: 7-chloro-8-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione CAS Name: 7-chloro-8-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione IUPAC Name: 7-chloro-8-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione Traditional Name: 7-chloro-8-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-quinone Formula: C16H17ClN4O6 MolecularWeight: 396.78238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1Cl)N=C3C(=O)NC(=O)N=C3N2CC(C(C(CO)O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1Cl)N=C3C(=O)NC(=O)N=C3N2CC(C(C(CO)O)O)O

InChI

InChI=1S/C16H17ClN4O6/c1-6-2-9-8(3-7(6)17)18-12-14(19-16(27)20-15(12)26)21(9)4-10(23)13(25)11(24)5-22/h2-3,10-11,13,22-25H,4-5H2,1H3,(H,20,26,27)