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6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylsulfanyl]hexanoic acid

6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylsulfanyl]hexanoic acid

Systemtic Name:6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylsulfanyl]hexanoic acid
Openeye Name:6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-thiochroman-4-yl]nonylsulfanyl]hexanoic acid
CAS Name:6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydro-1-benzothiopyran-4-yl]nonylthio]hexanoic acid
IUPAC Name:6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]nonylsulfanyl]hexanoic acid
Traditional Name:6-[9-[7-methoxy-3-(4-methoxyphenyl)-3-methyl-thiochroman-4-yl]nonylthio]hexanoic acid
Formula: C33H48O4S2
MolecularWeight: 572.86182
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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C1CCCCCCCCCSCCCCCC(=O)O)C=CC(=C2)OC)C3=CC=C(C=C3)OC


Isomeric SMILES

CC1(CSC2=C(C1CCCCCCCCCSCCCCCC(=O)O)C=CC(=C2)OC)C3=CC=C(C=C3)OC


InChI

InChI=1S/C33H48O4S2/c1-33(26-16-18-27(36-2)19-17-26)25-39-31-24-28(37-3)20-21-29(31)30(33)14-10-7-5-4-6-8-12-22-38-23-13-9-11-15-32(34)35/h16-21,24,30H,4-15,22-23,25H2,1-3H3,(H,34,35)


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