2-(3-methoxyphenyl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)ethanoic acid

Systemtic Name: 2-(3-methoxyphenyl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)ethanoic acid Openeye Name: 2-(3-methoxyphenyl)-2-(1-pyrimidin-2-yl-4-piperidyl)acetic acid CAS Name: 2-(3-methoxyphenyl)-2-[1-(2-pyrimidinyl)-4-piperidinyl]acetic acid IUPAC Name: 2-(3-methoxyphenyl)-2-(1-pyrimidin-2-ylpiperidin-4-yl)acetic acid Traditional Name: 2-(3-methoxyphenyl)-2-[1-(2-pyrimidyl)-4-piperidyl]acetic acid Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2CCN(CC2)C3=NC=CC=N3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2CCN(CC2)C3=NC=CC=N3)C(=O)O

InChI

InChI=1S/C18H21N3O3/c1-24-15-5-2-4-14(12-15)16(17(22)23)13-6-10-21(11-7-13)18-19-8-3-9-20-18/h2-5,8-9,12-13,16H,6-7,10-11H2,1H3,(H,22,23)