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

Systemtic Name: 2-(2-dimethylaminoethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 2-(2-dimethylaminoethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid CAS Name: 2-[(2-dimethylaminoethyldisulfanyl)-oxomethyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 2-(2-dimethylaminoethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 2-(2-dimethylaminoethyldisulfanyl)carbonyl-1,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSSC(=O)N1CC2=C(CC1C(=O)O)C3=CC=CC=C3N2

Isomeric SMILES

CN(C)CCSSC(=O)N1CC2=C(CC1C(=O)O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H21N3O3S2/c1-19(2)7-8-24-25-17(23)20-10-14-12(9-15(20)16(21)22)11-5-3-4-6-13(11)18-14/h3-6,15,18H,7-10H2,1-2H3,(H,21,22)