2-(dimethylamino)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 2-(dimethylamino)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzoic acid Openeye Name: 2-(dimethylamino)-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoic acid CAS Name: 2-(dimethylamino)-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid IUPAC Name: 2-(dimethylamino)-5-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 2-(dimethylamino)-5-(3,5-dimethylpiperidino)sulfonyl-benzoic acid Formula: C16H24N2O4S MolecularWeight: 340.43776

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)N(C)C)C(=O)O)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)N(C)C)C(=O)O)C

InChI

InChI=1S/C16H24N2O4S/c1-11-7-12(2)10-18(9-11)23(21,22)13-5-6-15(17(3)4)14(8-13)16(19)20/h5-6,8,11-12H,7,9-10H2,1-4H3,(H,19,20)