1-[(1-ethanoyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-ethanoyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-4-carboxylic acid Openeye Name: 1-(1-acetyl-2-methyl-indolin-5-yl)sulfonylpiperidine-4-carboxylic acid CAS Name: 1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]piperidine-4-carboxylic acid Traditional Name: 1-(1-acetyl-2-methyl-indolin-5-yl)sulfonylisonipecotic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C17H22N2O5S/c1-11-9-14-10-15(3-4-16(14)19(11)12(2)20)25(23,24)18-7-5-13(6-8-18)17(21)22/h3-4,10-11,13H,5-9H2,1-2H3,(H,21,22)