3-(2-sulfanylethyl)-1H-indole-2,7-dicarboxylic acid

Systemtic Name: 3-(2-sulfanylethyl)-1H-indole-2,7-dicarboxylic acid Openeye Name: 3-(2-sulfanylethyl)-1H-indole-2,7-dicarboxylic acid CAS Name: 3-(2-mercaptoethyl)-1H-indole-2,7-dicarboxylic acid IUPAC Name: 3-(2-sulfanylethyl)-1H-indole-2,7-dicarboxylic acid Traditional Name: 3-(2-mercaptoethyl)-1H-indole-2,7-dicarboxylic acid Formula: C12H11NO4S MolecularWeight: 265.28504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)O)NC(=C2CCS)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)O)NC(=C2CCS)C(=O)O

InChI

InChI=1S/C12H11NO4S/c14-11(15)8-3-1-2-6-7(4-5-18)10(12(16)17)13-9(6)8/h1-3,13,18H,4-5H2,(H,14,15)(H,16,17)