methyl 2-[4-oxidanyl-9,10-bis(oxidanylidene)-3-(3-oxidanylidenebutanoyl)anthracen-2-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanyl-9,10-bis(oxidanylidene)-3-(3-oxidanylidenebutanoyl)anthracen-2-yl]ethanoate Openeye Name: methyl 2-[4-hydroxy-9,10-dioxo-3-(3-oxobutanoyl)-2-anthryl]acetate CAS Name: 2-[3-(1,3-dioxobutyl)-4-hydroxy-9,10-dioxo-2-anthracenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-hydroxy-9,10-dioxo-3-(3-oxobutanoyl)anthracen-2-yl]acetate Traditional Name: 2-(3-acetoacetyl-4-hydroxy-9,10-diketo-2-anthryl)acetic acid methyl ester Formula: C21H16O7 MolecularWeight: 380.34754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)CC(=O)OC

Isomeric SMILES

CC(=O)CC(=O)C1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)CC(=O)OC

InChI

InChI=1S/C21H16O7/c1-10(22)7-15(23)17-11(9-16(24)28-2)8-14-18(21(17)27)20(26)13-6-4-3-5-12(13)19(14)25/h3-6,8,27H,7,9H2,1-2H3