methyl 7-[1-(4-butylphenyl)-6-methoxy-2-oxidanyl-6-oxidanylidene-hexyl]sulfanyl-4-oxidanylidene-8-propyl-chromene-2-carboxylate

Systemtic Name: methyl 7-[1-(4-butylphenyl)-6-methoxy-2-oxidanyl-6-oxidanylidene-hexyl]sulfanyl-4-oxidanylidene-8-propyl-chromene-2-carboxylate Openeye Name: methyl 7-[1-(4-butylphenyl)-2-hydroxy-6-methoxy-6-oxo-hexyl]sulfanyl-4-oxo-8-propyl-chromene-2-carboxylate CAS Name: 7-[[1-(4-butylphenyl)-2-hydroxy-6-methoxy-6-oxohexyl]thio]-4-oxo-8-propyl-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 7-[1-(4-butylphenyl)-2-hydroxy-6-methoxy-6-oxohexyl]sulfanyl-4-oxo-8-propylchromene-2-carboxylate Traditional Name: 7-[[1-(4-butylphenyl)-2-hydroxy-6-keto-6-methoxy-hexyl]thio]-4-keto-8-propyl-chromene-2-carboxylic acid methyl ester Formula: C31H38O7S MolecularWeight: 554.69422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C(CCCC(=O)OC)O)SC2=C(C3=C(C=C2)C(=O)C=C(O3)C(=O)OC)CCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(C(CCCC(=O)OC)O)SC2=C(C3=C(C=C2)C(=O)C=C(O3)C(=O)OC)CCC

InChI

InChI=1S/C31H38O7S/c1-5-7-10-20-13-15-21(16-14-20)30(24(32)11-8-12-28(34)36-3)39-27-18-17-22-25(33)19-26(31(35)37-4)38-29(22)23(27)9-6-2/h13-19,24,30,32H,5-12H2,1-4H3