2-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[[(3S)-3-methyl-1-piperidyl]methyl]phenyl]acetic acid CAS Name: 2-[4-[[(3S)-3-methyl-1-piperidinyl]methyl]phenyl]acetic acid IUPAC Name: 2-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]phenyl]acetic acid Traditional Name: 2-[4-[[(3S)-3-methylpiperidino]methyl]phenyl]acetic acid Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C[C@H]1CCCN(C1)CC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C15H21NO2/c1-12-3-2-8-16(10-12)11-14-6-4-13(5-7-14)9-15(17)18/h4-7,12H,2-3,8-11H2,1H3,(H,17,18)/t12-/m0/s1