methyl 6-[6-methoxy-1-(4-nonylphenyl)-2-oxidanyl-6-oxidanylidene-hexyl]sulfanyl-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: methyl 6-[6-methoxy-1-(4-nonylphenyl)-2-oxidanyl-6-oxidanylidene-hexyl]sulfanyl-2-oxidanylidene-chromene-3-carboxylate Openeye Name: methyl 6-[2-hydroxy-6-methoxy-1-(4-nonylphenyl)-6-oxo-hexyl]sulfanyl-2-oxo-chromene-3-carboxylate CAS Name: 6-[[2-hydroxy-6-methoxy-1-(4-nonylphenyl)-6-oxohexyl]thio]-2-oxo-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[2-hydroxy-6-methoxy-1-(4-nonylphenyl)-6-oxohexyl]sulfanyl-2-oxochromene-3-carboxylate Traditional Name: 6-[[2-hydroxy-6-keto-6-methoxy-1-(4-nonylphenyl)hexyl]thio]-2-keto-chromene-3-carboxylic acid methyl ester Formula: C33H42O7S MolecularWeight: 582.74738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C(C(CCCC(=O)OC)O)SC2=CC3=C(C=C2)OC(=O)C(=C3)C(=O)OC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C(C(CCCC(=O)OC)O)SC2=CC3=C(C=C2)OC(=O)C(=C3)C(=O)OC

InChI

InChI=1S/C33H42O7S/c1-4-5-6-7-8-9-10-12-23-15-17-24(18-16-23)31(28(34)13-11-14-30(35)38-2)41-26-19-20-29-25(21-26)22-27(32(36)39-3)33(37)40-29/h15-22,28,31,34H,4-14H2,1-3H3