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

Systemtic Name: 3-chloranyl-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-methoxy-benzoic acid Openeye Name: 3-chloro-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-methoxy-benzoic acid CAS Name: 3-chloro-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-methoxybenzoic acid IUPAC Name: 3-chloro-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-methoxybenzoic acid Traditional Name: 3-chloro-5-(3,5-dimethylpiperidino)sulfonyl-2-methoxy-benzoic acid Formula: C15H20ClNO5S MolecularWeight: 361.841

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C(=C2)C(=O)O)OC)Cl)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C(=C2)C(=O)O)OC)Cl)C

InChI

InChI=1S/C15H20ClNO5S/c1-9-4-10(2)8-17(7-9)23(20,21)11-5-12(15(18)19)14(22-3)13(16)6-11/h5-6,9-10H,4,7-8H2,1-3H3,(H,18,19)