[2-acetyloxy-2-[6-methoxy-1-(4-methylphenyl)sulfonyl-4,7-bis(oxidanylidene)indol-3-yl]ethyl] ethanoate

Systemtic Name: [2-acetyloxy-2-[6-methoxy-1-(4-methylphenyl)sulfonyl-4,7-bis(oxidanylidene)indol-3-yl]ethyl] ethanoate Openeye Name: [2-acetoxy-2-[6-methoxy-4,7-dioxo-1-(p-tolylsulfonyl)indol-3-yl]ethyl] acetate CAS Name: acetic acid [2-acetyloxy-2-[6-methoxy-1-(4-methylphenyl)sulfonyl-4,7-dioxo-3-indolyl]ethyl] ester IUPAC Name: [2-acetyloxy-2-[6-methoxy-1-(4-methylphenyl)sulfonyl-4,7-dioxoindol-3-yl]ethyl] acetate Traditional Name: acetic acid [2-acetoxy-2-(4,7-diketo-6-methoxy-1-tosyl-indol-3-yl)ethyl] ester Formula: C22H21NO9S MolecularWeight: 475.46844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C(=O)C(=CC3=O)OC)C(COC(=O)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C(=O)C(=CC3=O)OC)C(COC(=O)C)OC(=O)C

InChI

InChI=1S/C22H21NO9S/c1-12-5-7-15(8-6-12)33(28,29)23-10-16(19(32-14(3)25)11-31-13(2)24)20-17(26)9-18(30-4)22(27)21(20)23/h5-10,19H,11H2,1-4H3