tert-butyl 4-[2-ethoxy-1-(2-methylpyridin-3-yl)-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-ethoxy-1-(2-methylpyridin-3-yl)-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-ethoxy-1-(2-methyl-3-pyridyl)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-ethoxy-1-(2-methyl-3-pyridinyl)-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-ethoxy-1-(2-methylpyridin-3-yl)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-ethoxy-2-keto-1-(2-methyl-3-pyridyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N=CC=C1)C)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C1=C(N=CC=C1)C)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H29N3O4/c1-6-25-17(23)16(15-8-7-9-20-14(15)2)21-10-12-22(13-11-21)18(24)26-19(3,4)5/h7-9,16H,6,10-13H2,1-5H3