6-(2-ethylsulfonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-(2-ethylsulfonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-(2-ethylsulfonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-(2-ethylsulfonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-(2-ethylsulfonylphenoxy)-4-(methoxymethyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-(2-esylphenoxy)-4-(methoxymethyl)-9H-$b-carboline-3-carboxylic acid Formula: C22H20N2O6S MolecularWeight: 440.469

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1OC2=CC3=C(C=C2)NC4=CN=C(C(=C34)COC)C(=O)O

InChI

InChI=1S/C22H20N2O6S/c1-3-31(27,28)19-7-5-4-6-18(19)30-13-8-9-16-14(10-13)20-15(12-29-2)21(22(25)26)23-11-17(20)24-16/h4-11,24H,3,12H2,1-2H3,(H,25,26)