[4-acetyloxy-2,5-bis(2-aminocarbonyl-1H-indol-3-yl)-3,6-bis(oxidanylidene)cyclohexyl] ethanoate

Systemtic Name: [4-acetyloxy-2,5-bis(2-aminocarbonyl-1H-indol-3-yl)-3,6-bis(oxidanylidene)cyclohexyl] ethanoate Openeye Name: [4-acetoxy-2,5-bis(2-carbamoyl-1H-indol-3-yl)-3,6-dioxo-cyclohexyl] acetate CAS Name: acetic acid [4-acetyloxy-2,5-bis(2-carbamoyl-1H-indol-3-yl)-3,6-dioxocyclohexyl] ester IUPAC Name: [4-acetyloxy-2,5-bis(2-carbamoyl-1H-indol-3-yl)-3,6-dioxocyclohexyl] acetate Traditional Name: acetic acid [4-acetoxy-2,5-bis(2-carbamoyl-1H-indol-3-yl)-3,6-diketo-cyclohexyl] ester Formula: C28H24N4O8 MolecularWeight: 544.51216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(=O)C(C(C1=O)C2=C(NC3=CC=CC=C32)C(=O)N)OC(=O)C)C4=C(NC5=CC=CC=C54)C(=O)N

Isomeric SMILES

CC(=O)OC1C(C(=O)C(C(C1=O)C2=C(NC3=CC=CC=C32)C(=O)N)OC(=O)C)C4=C(NC5=CC=CC=C54)C(=O)N

InChI

InChI=1S/C28H24N4O8/c1-11(33)39-25-19(17-13-7-3-5-9-15(13)31-21(17)27(29)37)24(36)26(40-12(2)34)20(23(25)35)18-14-8-4-6-10-16(14)32-22(18)28(30)38/h3-10,19-20,25-26,31-32H,1-2H3,(H2,29,37)(H2,30,38)