4,6-dimethyl-3,5,6,10,11,12a-hexakis(oxidanyl)-1,12-bis(oxidanylidene)-2,3,4,4a,5,5a-hexahydrotetracene-2-carboxamide

Systemtic Name: 4,6-dimethyl-3,5,6,10,11,12a-hexakis(oxidanyl)-1,12-bis(oxidanylidene)-2,3,4,4a,5,5a-hexahydrotetracene-2-carboxamide Openeye Name: 3,5,6,10,11,12a-hexahydroxy-4,6-dimethyl-1,12-dioxo-2,3,4,4a,5,5a-hexahydrotetracene-2-carboxamide CAS Name: 3,5,6,10,11,12a-hexahydroxy-4,6-dimethyl-1,12-dioxo-2,3,4,4a,5,5a-hexahydrotetracene-2-carboxamide IUPAC Name: 3,5,6,10,11,12a-hexahydroxy-4,6-dimethyl-1,12-dioxo-2,3,4,4a,5,5a-hexahydrotetracene-2-carboxamide Traditional Name: 3,5,6,10,11,12a-hexahydroxy-1,12-diketo-4,6-dimethyl-2,3,4,4a,5,5a-hexahydrotetracene-2-carboxamide Formula: C21H23NO9 MolecularWeight: 433.40862

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C3C(=C(C4=C(C3(C)O)C=CC=C4O)O)C(=O)C2(C(=O)C(C1O)C(=O)N)O)O

Isomeric SMILES

CC1C2C(C3C(=C(C4=C(C3(C)O)C=CC=C4O)O)C(=O)C2(C(=O)C(C1O)C(=O)N)O)O

InChI

InChI=1S/C21H23NO9/c1-6-12-16(26)13-10(15(25)9-7(20(13,2)30)4-3-5-8(9)23)17(27)21(12,31)18(28)11(14(6)24)19(22)29/h3-6,11-14,16,23-26,30-31H,1-2H3,(H2,22,29)