3-[1-[5-(4-ethoxyphenyl)thiophen-2-yl]sulfonyl-5-methoxy-indol-3-yl]propanoic acid

Systemtic Name: 3-[1-[5-(4-ethoxyphenyl)thiophen-2-yl]sulfonyl-5-methoxy-indol-3-yl]propanoic acid Openeye Name: 3-[1-[[5-(4-ethoxyphenyl)-2-thienyl]sulfonyl]-5-methoxy-indol-3-yl]propanoic acid CAS Name: 3-[1-[[5-(4-ethoxyphenyl)-2-thiophenyl]sulfonyl]-5-methoxy-3-indolyl]propanoic acid IUPAC Name: 3-[1-[5-(4-ethoxyphenyl)thiophen-2-yl]sulfonyl-5-methoxyindol-3-yl]propanoic acid Traditional Name: 3-[5-methoxy-1-[(5-p-phenetyl-2-thienyl)sulfonyl]indol-3-yl]propionic acid Formula: C24H23NO6S2 MolecularWeight: 485.57252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3C=C(C4=C3C=CC(=C4)OC)CCC(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3C=C(C4=C3C=CC(=C4)OC)CCC(=O)O

InChI

InChI=1S/C24H23NO6S2/c1-3-31-18-7-4-16(5-8-18)22-11-13-24(32-22)33(28,29)25-15-17(6-12-23(26)27)20-14-19(30-2)9-10-21(20)25/h4-5,7-11,13-15H,3,6,12H2,1-2H3,(H,26,27)