7-[1-(3-decyl-6-sulfanylidene-cyclohexa-1,3-dien-1-yl)-6-methoxy-6-oxidanylidene-hexyl]sulfanyl-3-methyl-4-oxidanylidene-8-propyl-chromene-2-carboxylate

Systemtic Name: 7-[1-(3-decyl-6-sulfanylidene-cyclohexa-1,3-dien-1-yl)-6-methoxy-6-oxidanylidene-hexyl]sulfanyl-3-methyl-4-oxidanylidene-8-propyl-chromene-2-carboxylate Openeye Name: 7-[1-(3-decyl-6-thioxo-cyclohexa-1,3-dien-1-yl)-6-methoxy-6-oxo-hexyl]sulfanyl-3-methyl-4-oxo-8-propyl-chromene-2-carboxylate CAS Name: 7-[[1-(3-decyl-6-sulfanylidene-1-cyclohexa-1,3-dienyl)-6-methoxy-6-oxohexyl]thio]-3-methyl-4-oxo-8-propyl-1-benzopyran-2-carboxylate IUPAC Name: 7-[1-(3-decyl-6-sulfanylidenecyclohexa-1,3-dien-1-yl)-6-methoxy-6-oxohexyl]sulfanyl-3-methyl-4-oxo-8-propylchromene-2-carboxylate Traditional Name: 7-[[1-(3-decyl-6-thioxo-cyclohexa-1,3-dien-1-yl)-6-keto-6-methoxy-hexyl]thio]-4-keto-3-methyl-8-propyl-chromene-2-carboxylate Formula: C37H49O6S2- MolecularWeight: 653.91136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CCC(=S)C(=C1)C(CCCCC(=O)OC)SC2=C(C3=C(C=C2)C(=O)C(=C(O3)C(=O)[O-])C)CCC

Isomeric SMILES

CCCCCCCCCCC1=CCC(=S)C(=C1)C(CCCCC(=O)OC)SC2=C(C3=C(C=C2)C(=O)C(=C(O3)C(=O)[O-])C)CCC

InChI

InChI=1S/C37H50O6S2/c1-5-7-8-9-10-11-12-13-17-26-20-22-30(44)29(24-26)31(18-14-15-19-33(38)42-4)45-32-23-21-28-34(39)25(3)35(37(40)41)43-36(28)27(32)16-6-2/h20-21,23-24,31H,5-19,22H2,1-4H3,(H,40,41)/p-1