2-(propan-2-yldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 2-(propan-2-yldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 2-(isopropyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid CAS Name: 2-[oxo-(propan-2-yldisulfanyl)methyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 2-(propan-2-yldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 2-(isopropyldisulfanyl)carbonyl-1,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid Formula: C16H18N2O3S2 MolecularWeight: 350.45572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SSC(=O)N1CC2=C(CC1C(=O)O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)SSC(=O)N1CC2=C(CC1C(=O)O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H18N2O3S2/c1-9(2)22-23-16(21)18-8-13-11(7-14(18)15(19)20)10-5-3-4-6-12(10)17-13/h3-6,9,14,17H,7-8H2,1-2H3,(H,19,20)