(1,3-dimethyl-8-oxidanylidene-6-thiophen-2-yl-cyclohepta[c]furan-4-yl) 4-methoxybenzoate

Systemtic Name: (1,3-dimethyl-8-oxidanylidene-6-thiophen-2-yl-cyclohepta[c]furan-4-yl) 4-methoxybenzoate Openeye Name: [1,3-dimethyl-8-oxo-6-(2-thienyl)cyclohepta[c]furan-4-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (1,3-dimethyl-8-oxo-6-thiophen-2-yl-4-cyclohepta[c]furanyl) ester IUPAC Name: (1,3-dimethyl-8-oxo-6-thiophen-2-ylcyclohepta[c]furan-4-yl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [8-keto-1,3-dimethyl-6-(2-thienyl)cyclohepta[c]furan-4-yl] ester Formula: C23H18O5S MolecularWeight: 406.45102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC=CS3)OC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC=CS3)OC(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H18O5S/c1-13-21-18(24)11-16(20-5-4-10-29-20)12-19(22(21)14(2)27-13)28-23(25)15-6-8-17(26-3)9-7-15/h4-12H,1-3H3