3-[4-[(3S)-3-methylpiperidin-1-yl]carbonylphenoxy]propanoic acid

Systemtic Name: 3-[4-[(3S)-3-methylpiperidin-1-yl]carbonylphenoxy]propanoic acid Openeye Name: 3-[4-[(3S)-3-methylpiperidine-1-carbonyl]phenoxy]propanoic acid CAS Name: 3-[4-[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]phenoxy]propanoic acid IUPAC Name: 3-[4-[(3S)-3-methylpiperidine-1-carbonyl]phenoxy]propanoic acid Traditional Name: 3-[4-[(3S)-3-methylpiperidine-1-carbonyl]phenoxy]propionic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-12-3-2-9-17(11-12)16(20)13-4-6-14(7-5-13)21-10-8-15(18)19/h4-7,12H,2-3,8-11H2,1H3,(H,18,19)/t12-/m0/s1