(3S)-9-methyl-2-methylsulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: (3S)-9-methyl-2-methylsulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: (3S)-9-methyl-2-methylsulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: (3S)-9-methyl-2-methylsulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: (3S)-9-methyl-2-methylsulfonyl-3,4-dihydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: (3S)-2-mesyl-9-methyl-3,4-dihydro-1H-$b-carboline-3-carboxylic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(N(C2)S(=O)(=O)C)C(=O)O)C3=CC=CC=C31

Isomeric SMILES

CN1C2=C(C[C@H](N(C2)S(=O)(=O)C)C(=O)O)C3=CC=CC=C31

InChI

InChI=1S/C14H16N2O4S/c1-15-11-6-4-3-5-9(11)10-7-12(14(17)18)16(8-13(10)15)21(2,19)20/h3-6,12H,7-8H2,1-2H3,(H,17,18)/t12-/m0/s1