[1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-(4-benzyl-1-piperidyl)-1-methyl-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]propan-2-yl] ester IUPAC Name: [1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-(4-benzylpiperidino)-2-keto-1-methyl-ethyl] ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OC(C)C(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OC(C)C(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3/c1-15-13-23-19(14-22-15)21(26)27-16(2)20(25)24-10-8-18(9-11-24)12-17-6-4-3-5-7-17/h3-7,13-14,16,18H,8-12H2,1-2H3