[4-bromanyl-2,5-bis(4-methoxyphenyl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl] ethanoate

Systemtic Name: [4-bromanyl-2,5-bis(4-methoxyphenyl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl] ethanoate Openeye Name: [4-bromo-2,5-bis(4-methoxyphenyl)-3,6-dioxo-cyclohexa-1,4-dien-1-yl] acetate CAS Name: acetic acid [4-bromo-2,5-bis(4-methoxyphenyl)-3,6-dioxo-1-cyclohexa-1,4-dienyl] ester IUPAC Name: [4-bromo-2,5-bis(4-methoxyphenyl)-3,6-dioxocyclohexa-1,4-dien-1-yl] acetate Traditional Name: acetic acid [4-bromo-3,6-diketo-2,5-bis(4-methoxyphenyl)cyclohexa-1,4-dien-1-yl] ester Formula: C22H17BrO6 MolecularWeight: 457.27078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=O)C(=C(C1=O)C2=CC=C(C=C2)OC)Br)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)OC1=C(C(=O)C(=C(C1=O)C2=CC=C(C=C2)OC)Br)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H17BrO6/c1-12(24)29-22-18(14-6-10-16(28-3)11-7-14)20(25)19(23)17(21(22)26)13-4-8-15(27-2)9-5-13/h4-11H,1-3H3