(4aS,5aR,6R,12aS)-6-methyl-9-nitro-10,12a-bis(oxidanyl)-1,3,11,12-tetrakis(oxidanylidene)-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide

Systemtic Name: (4aS,5aR,6R,12aS)-6-methyl-9-nitro-10,12a-bis(oxidanyl)-1,3,11,12-tetrakis(oxidanylidene)-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide Openeye Name: (4aS,5aR,6R,12aS)-10,12a-dihydroxy-6-methyl-9-nitro-1,3,11,12-tetraoxo-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide CAS Name: (4aS,5aR,6R,12aS)-10,12a-dihydroxy-6-methyl-9-nitro-1,3,11,12-tetraoxo-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide IUPAC Name: (4aS,5aR,6R,12aS)-10,12a-dihydroxy-6-methyl-9-nitro-1,3,11,12-tetraoxo-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide Traditional Name: (4aS,5aR,6R,12aS)-10,12a-dihydroxy-1,3,11,12-tetraketo-6-methyl-9-nitro-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide Formula: C20H18N2O9 MolecularWeight: 430.36492

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC3CC(=O)C(C(=O)C3(C(=O)C2C(=O)C4=C1C=CC(=C4O)[N+](=O)[O-])O)C(=O)N

Isomeric SMILES

C[C@@H]1[C@H]2C[C@H]3CC(=O)C(C(=O)[C@]3(C(=O)C2C(=O)C4=C1C=CC(=C4O)[N+](=O)[O-])O)C(=O)N

InChI

InChI=1S/C20H18N2O9/c1-6-8-2-3-10(22(30)31)15(24)12(8)16(25)13-9(6)4-7-5-11(23)14(19(21)28)18(27)20(7,29)17(13)26/h2-3,6-7,9,13-14,24,29H,4-5H2,1H3,(H2,21,28)/t6-,7-,9+,13?,14?,20-/m0/s1