3-[(2-carboxy-1H-indol-3-yl)sulfanyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(2-carboxy-1H-indol-3-yl)sulfanyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[(2-carboxy-1H-indol-3-yl)sulfanyl]-1H-indole-2-carboxylic acid CAS Name: 3-[(2-carboxy-1H-indol-3-yl)thio]-1H-indole-2-carboxylic acid IUPAC Name: 3-[(2-carboxy-1H-indol-3-yl)sulfanyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[(2-carboxy-1H-indol-3-yl)thio]-1H-indole-2-carboxylic acid Formula: C18H12N2O4S MolecularWeight: 352.36388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)SC3=C(NC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)SC3=C(NC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C18H12N2O4S/c21-17(22)13-15(9-5-1-3-7-11(9)19-13)25-16-10-6-2-4-8-12(10)20-14(16)18(23)24/h1-8,19-20H,(H,21,22)(H,23,24)