ethyl 4-[2-(2-methoxyphenyl)-6-oxidanylidene-4-thiophen-2-yl-cyclohexa-1,4-dien-1-yl]-2,4-bis(oxidanylidene)butanoate

Systemtic Name: ethyl 4-[2-(2-methoxyphenyl)-6-oxidanylidene-4-thiophen-2-yl-cyclohexa-1,4-dien-1-yl]-2,4-bis(oxidanylidene)butanoate Openeye Name: ethyl 4-[2-(2-methoxyphenyl)-6-oxo-4-(2-thienyl)cyclohexa-1,4-dien-1-yl]-2,4-dioxo-butanoate CAS Name: 4-[2-(2-methoxyphenyl)-6-oxo-4-thiophen-2-yl-1-cyclohexa-1,4-dienyl]-2,4-dioxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-methoxyphenyl)-6-oxo-4-thiophen-2-ylcyclohexa-1,4-dien-1-yl]-2,4-dioxobutanoate Traditional Name: 2,4-diketo-4-[6-keto-2-(2-methoxyphenyl)-4-(2-thienyl)cyclohexa-1,4-dien-1-yl]butyric acid ethyl ester Formula: C23H20O6S MolecularWeight: 424.4663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CC(=O)C1=C(CC(=CC1=O)C2=CC=CS2)C3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)C(=O)CC(=O)C1=C(CC(=CC1=O)C2=CC=CS2)C3=CC=CC=C3OC

InChI

InChI=1S/C23H20O6S/c1-3-29-23(27)19(26)13-18(25)22-16(15-7-4-5-8-20(15)28-2)11-14(12-17(22)24)21-9-6-10-30-21/h4-10,12H,3,11,13H2,1-2H3