2-[4-[(E)-3-[4-[5-(1,2-dithiolan-3-yl)pentoxy]-3,5-dimethyl-phenyl]-3-oxidanylidene-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[(E)-3-[4-[5-(1,2-dithiolan-3-yl)pentoxy]-3,5-dimethyl-phenyl]-3-oxidanylidene-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[(E)-3-[4-[5-(dithiolan-3-yl)pentoxy]-3,5-dimethyl-phenyl]-3-oxo-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[(E)-3-[4-[5-(3-dithiolanyl)pentoxy]-3,5-dimethylphenyl]-3-oxoprop-1-enyl]-2,6-dimethylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[(E)-3-[4-[5-(dithiolan-3-yl)pentoxy]-3,5-dimethylphenyl]-3-oxoprop-1-enyl]-2,6-dimethylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[(E)-3-[4-[5-(dithiolan-3-yl)pentoxy]-3,5-dimethyl-phenyl]-3-keto-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propionic acid Formula: C31H40O5S2 MolecularWeight: 556.7763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)(C)C(=O)O)C)C=CC(=O)C2=CC(=C(C(=C2)C)OCCCCCC3CCSS3)C

Isomeric SMILES

CC1=CC(=CC(=C1OC(C)(C)C(=O)O)C)/C=C/C(=O)C2=CC(=C(C(=C2)C)OCCCCCC3CCSS3)C

InChI

InChI=1S/C31H40O5S2/c1-20-16-24(17-21(2)29(20)36-31(5,6)30(33)34)11-12-27(32)25-18-22(3)28(23(4)19-25)35-14-9-7-8-10-26-13-15-37-38-26/h11-12,16-19,26H,7-10,13-15H2,1-6H3,(H,33,34)/b12-11+