2-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]ethanoic acid Openeye Name: 2-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]acetic acid CAS Name: 2-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]acetic acid IUPAC Name: 2-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]acetic acid Traditional Name: 2-[4-(2-methylpiperidino)sulfonylphenyl]acetic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C14H19NO4S/c1-11-4-2-3-9-15(11)20(18,19)13-7-5-12(6-8-13)10-14(16)17/h5-8,11H,2-4,9-10H2,1H3,(H,16,17)