[4-(3-methoxyphenyl)carbonyloxy-3,6-bis(oxidanylidene)-5-undecyl-cyclohexa-1,4-dien-1-yl] 3-methoxybenzoate

Systemtic Name: [4-(3-methoxyphenyl)carbonyloxy-3,6-bis(oxidanylidene)-5-undecyl-cyclohexa-1,4-dien-1-yl] 3-methoxybenzoate Openeye Name: [4-(3-methoxybenzoyl)oxy-3,6-dioxo-5-undecyl-cyclohexa-1,4-dien-1-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[(3-methoxyphenyl)-oxomethoxy]-3,6-dioxo-5-undecyl-1-cyclohexa-1,4-dienyl] ester IUPAC Name: [4-(3-methoxybenzoyl)oxy-3,6-dioxo-5-undecylcyclohexa-1,4-dien-1-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid (3,6-diketo-4-m-anisoyloxy-5-undecyl-cyclohexa-1,4-dien-1-yl) ester Formula: C33H38O8 MolecularWeight: 562.65002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC(=O)C2=CC(=CC=C2)OC)OC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC(=O)C2=CC(=CC=C2)OC)OC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C33H38O8/c1-4-5-6-7-8-9-10-11-12-19-27-30(35)29(40-32(36)23-15-13-17-25(20-23)38-2)22-28(34)31(27)41-33(37)24-16-14-18-26(21-24)39-3/h13-18,20-22H,4-12,19H2,1-3H3