5-[(2S,3R,4R)-2,3,4,5-tetrakis(oxidanyl)pentyl]-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione

Systemtic Name: 5-[(2S,3R,4R)-2,3,4,5-tetrakis(oxidanyl)pentyl]-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione Openeye Name: 5-[(2S,3R,4R)-2,3,4,5-tetrahydroxypentyl]-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione CAS Name: 5-[(2S,3R,4R)-2,3,4,5-tetrahydroxypentyl]-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione IUPAC Name: 5-[(2S,3R,4R)-2,3,4,5-tetrahydroxypentyl]-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione Traditional Name: 5-[(2S,3R,4R)-2,3,4,5-tetrahydroxypentyl]-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepine-6,11-quinone Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(=O)N(C3=CC=CC=C3C(=O)N2C1)CC(C(C(CO)O)O)O

Isomeric SMILES

C1CC2C(=O)N(C3=CC=CC=C3C(=O)N2C1)C[C@@H]([C@H]([C@@H](CO)O)O)O

InChI

InChI=1S/C17H22N2O6/c20-9-14(22)15(23)13(21)8-19-11-5-2-1-4-10(11)16(24)18-7-3-6-12(18)17(19)25/h1-2,4-5,12-15,20-23H,3,6-9H2/t12?,13-,14+,15+/m0/s1