3-(5-methoxy-1-thiophen-3-ylsulfonyl-indol-3-yl)propanoic acid

Systemtic Name: 3-(5-methoxy-1-thiophen-3-ylsulfonyl-indol-3-yl)propanoic acid Openeye Name: 3-[5-methoxy-1-(3-thienylsulfonyl)indol-3-yl]propanoic acid CAS Name: 3-[5-methoxy-1-(3-thiophenylsulfonyl)-3-indolyl]propanoic acid IUPAC Name: 3-(5-methoxy-1-thiophen-3-ylsulfonylindol-3-yl)propanoic acid Traditional Name: 3-[5-methoxy-1-(3-thienylsulfonyl)indol-3-yl]propionic acid Formula: C16H15NO5S2 MolecularWeight: 365.424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CSC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2CCC(=O)O)S(=O)(=O)C3=CSC=C3

InChI

InChI=1S/C16H15NO5S2/c1-22-12-3-4-15-14(8-12)11(2-5-16(18)19)9-17(15)24(20,21)13-6-7-23-10-13/h3-4,6-10H,2,5H2,1H3,(H,18,19)