S-methyl 3-methoxy-4-oxidanylidene-3-[(2E)-penta-2,4-dienoxy]-9,10-dihydroanthracene-1-carbothioate

Systemtic Name: S-methyl 3-methoxy-4-oxidanylidene-3-[(2E)-penta-2,4-dienoxy]-9,10-dihydroanthracene-1-carbothioate Openeye Name: S-methyl 3-methoxy-4-oxo-3-[(2E)-penta-2,4-dienoxy]-9,10-dihydroanthracene-1-carbothioate CAS Name: 3-methoxy-4-oxo-3-[(2E)-penta-2,4-dienoxy]-9,10-dihydroanthracene-1-carbothioic acid S-methyl ester IUPAC Name: S-methyl 3-methoxy-4-oxo-3-[(2E)-penta-2,4-dienoxy]-9,10-dihydroanthracene-1-carbothioate Traditional Name: 4-keto-3-methoxy-3-[(2E)-penta-2,4-dienoxy]-9,10-dihydroanthracene-1-carbothioic acid S-methyl ester Formula: C22H22O4S MolecularWeight: 382.47268

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C=C(C2=C(C1=O)CC3=CC=CC=C3C2)C(=O)SC)OCC=CC=C

Isomeric SMILES

COC1(C=C(C2=C(C1=O)CC3=CC=CC=C3C2)C(=O)SC)OC/C=C/C=C

InChI

InChI=1S/C22H22O4S/c1-4-5-8-11-26-22(25-2)14-19(21(24)27-3)17-12-15-9-6-7-10-16(15)13-18(17)20(22)23/h4-10,14H,1,11-13H2,2-3H3/b8-5+