2-methylsulfanyl-8-phenylmethoxy-indolizine-1,3-dicarboxylic acid

Systemtic Name: 2-methylsulfanyl-8-phenylmethoxy-indolizine-1,3-dicarboxylic acid Openeye Name: 8-benzyloxy-2-methylsulfanyl-indolizine-1,3-dicarboxylic acid CAS Name: 2-(methylthio)-8-phenylmethoxyindolizine-1,3-dicarboxylic acid IUPAC Name: 2-methylsulfanyl-8-phenylmethoxyindolizine-1,3-dicarboxylic acid Traditional Name: 8-benzoxy-2-(methylthio)indolizine-1,3-dicarboxylic acid Formula: C18H15NO5S MolecularWeight: 357.3804

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N2C=CC=C(C2=C1C(=O)O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CSC1=C(N2C=CC=C(C2=C1C(=O)O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H15NO5S/c1-25-16-13(17(20)21)14-12(24-10-11-6-3-2-4-7-11)8-5-9-19(14)15(16)18(22)23/h2-9H,10H2,1H3,(H,20,21)(H,22,23)