1-[(3,3-dimethyl-2-oxidanylidene-1H-indol-5-yl)sulfonyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3,3-dimethyl-2-oxidanylidene-1H-indol-5-yl)sulfonyl]piperidine-3-carboxylic acid Openeye Name: 1-(3,3-dimethyl-2-oxo-indolin-5-yl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-[(3,3-dimethyl-2-oxo-1H-indol-5-yl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3,3-dimethyl-2-oxo-1H-indol-5-yl)sulfonyl]piperidine-3-carboxylic acid Traditional Name: 1-(2-keto-3,3-dimethyl-indolin-5-yl)sulfonylnipecotic acid Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)O)NC1=O)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)O)NC1=O)C

InChI

InChI=1S/C16H20N2O5S/c1-16(2)12-8-11(5-6-13(12)17-15(16)21)24(22,23)18-7-3-4-10(9-18)14(19)20/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,17,21)(H,19,20)