3-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylsulfonyl)thiophene-2-carboxylic acid

Systemtic Name: 3-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylsulfonyl)thiophene-2-carboxylic acid Openeye Name: 3-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylsulfonyl)thiophene-2-carboxylic acid CAS Name: 3-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylsulfonyl)-2-thiophenecarboxylic acid IUPAC Name: 3-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-ylsulfonyl)thiophene-2-carboxylic acid Traditional Name: 3-(1,3,4,5-tetrahydropyrid[4,3-b]indol-2-ylsulfonyl)-2-thenoic acid Formula: C16H14N2O4S2 MolecularWeight: 362.42336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1NC3=CC=CC=C23)S(=O)(=O)C4=C(SC=C4)C(=O)O

Isomeric SMILES

C1CN(CC2=C1NC3=CC=CC=C23)S(=O)(=O)C4=C(SC=C4)C(=O)O

InChI

InChI=1S/C16H14N2O4S2/c19-16(20)15-14(6-8-23-15)24(21,22)18-7-5-13-11(9-18)10-3-1-2-4-12(10)17-13/h1-4,6,8,17H,5,7,9H2,(H,19,20)