2-[(3-cyclopentyloxy-4-methoxy-phenyl)-(2-phenyl-1,3-dithian-2-yl)methyl]-3-ethoxy-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[(3-cyclopentyloxy-4-methoxy-phenyl)-(2-phenyl-1,3-dithian-2-yl)methyl]-3-ethoxy-3-oxidanylidene-propanoic acid Openeye Name: 2-[[3-(cyclopentoxy)-4-methoxy-phenyl]-(2-phenyl-1,3-dithian-2-yl)methyl]-3-ethoxy-3-oxo-propanoic acid CAS Name: 2-[(3-cyclopentyloxy-4-methoxyphenyl)-(2-phenyl-1,3-dithian-2-yl)methyl]-3-ethoxy-3-oxopropanoic acid IUPAC Name: 2-[(3-cyclopentyloxy-4-methoxyphenyl)-(2-phenyl-1,3-dithian-2-yl)methyl]-3-ethoxy-3-oxopropanoic acid Traditional Name: 2-carbethoxy-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-(2-phenyl-1,3-dithian-2-yl)propionic acid Formula: C28H34O6S2 MolecularWeight: 530.69596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC(=C(C=C1)OC)OC2CCCC2)C3(SCCCS3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCOC(=O)C(C(C1=CC(=C(C=C1)OC)OC2CCCC2)C3(SCCCS3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H34O6S2/c1-3-33-27(31)24(26(29)30)25(28(35-16-9-17-36-28)20-10-5-4-6-11-20)19-14-15-22(32-2)23(18-19)34-21-12-7-8-13-21/h4-6,10-11,14-15,18,21,24-25H,3,7-9,12-13,16-17H2,1-2H3,(H,29,30)