3-methyl-2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-ylsulfonylmethyl)butanoic acid

Systemtic Name: 3-methyl-2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-ylsulfonylmethyl)butanoic acid Openeye Name: 3-methyl-2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-ylsulfonylmethyl)butanoic acid CAS Name: 3-methyl-2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-ylsulfonylmethyl)butanoic acid IUPAC Name: 3-methyl-2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-ylsulfonylmethyl)butanoic acid Traditional Name: 3-methyl-2-(1,3,4,9-tetrahydro-$b-carbolin-2-ylsulfonylmethyl)butyric acid Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CS(=O)(=O)N1CCC2=C(C1)NC3=CC=CC=C23)C(=O)O

Isomeric SMILES

CC(C)C(CS(=O)(=O)N1CCC2=C(C1)NC3=CC=CC=C23)C(=O)O

InChI

InChI=1S/C17H22N2O4S/c1-11(2)14(17(20)21)10-24(22,23)19-8-7-13-12-5-3-4-6-15(12)18-16(13)9-19/h3-6,11,14,18H,7-10H2,1-2H3,(H,20,21)