(phenylmethyl) 2-[ethanoyl(methyl)amino]-4-(2-methylpyridin-4-yl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[ethanoyl(methyl)amino]-4-(2-methylpyridin-4-yl)piperazine-1-carboxylate Openeye Name: benzyl 2-[acetyl(methyl)amino]-4-(2-methyl-4-pyridyl)piperazine-1-carboxylate CAS Name: 2-[acetyl(methyl)amino]-4-(2-methyl-4-pyridinyl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[acetyl(methyl)amino]-4-(2-methylpyridin-4-yl)piperazine-1-carboxylate Traditional Name: 2-[acetyl(methyl)amino]-4-(2-methyl-4-pyridyl)piperazine-1-carboxylic acid benzyl ester Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CCN(C(C2)N(C)C(=O)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=CC(=C1)N2CCN(C(C2)N(C)C(=O)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3/c1-16-13-19(9-10-22-16)24-11-12-25(20(14-24)23(3)17(2)26)21(27)28-15-18-7-5-4-6-8-18/h4-10,13,20H,11-12,14-15H2,1-3H3