2-[4-[5-(methylcarbamoyl)-4-(2-methylphenyl)pyridin-2-yl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[5-(methylcarbamoyl)-4-(2-methylphenyl)pyridin-2-yl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[5-(methylcarbamoyl)-4-(o-tolyl)-2-pyridyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[5-(methylcarbamoyl)-4-(2-methylphenyl)-2-pyridinyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[5-(methylcarbamoyl)-4-(2-methylphenyl)pyridin-2-yl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[5-(methylcarbamoyl)-4-(o-tolyl)-2-pyridyl]piperazino]acetic acid Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=NC=C2C(=O)NC)N3CCN(CC3)CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=NC=C2C(=O)NC)N3CCN(CC3)CC(=O)O

InChI

InChI=1S/C20H24N4O3/c1-14-5-3-4-6-15(14)16-11-18(22-12-17(16)20(27)21-2)24-9-7-23(8-10-24)13-19(25)26/h3-6,11-12H,7-10,13H2,1-2H3,(H,21,27)(H,25,26)