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

Systemtic Name: 2-(cyclohexyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 2-(cyclohexyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid CAS Name: 2-[(cyclohexyldisulfanyl)-oxomethyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 2-(cyclohexyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 2-(cyclohexyldisulfanyl)carbonyl-1,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SSC(=O)N2CC3=C(CC2C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCC(CC1)SSC(=O)N2CC3=C(CC2C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H22N2O3S2/c22-18(23)17-10-14-13-8-4-5-9-15(13)20-16(14)11-21(17)19(24)26-25-12-6-2-1-3-7-12/h4-5,8-9,12,17,20H,1-3,6-7,10-11H2,(H,22,23)