tert-butyl 4-(2-methoxy-2-oxidanylidene-1-pyridin-2-yl-ethyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methoxy-2-oxidanylidene-1-pyridin-2-yl-ethyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-methoxy-2-oxo-1-(2-pyridyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-methoxy-2-oxo-1-(2-pyridinyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methoxy-2-oxo-1-pyridin-2-ylethyl)piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-methoxy-1-(2-pyridyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CC=CC=N2)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CC=CC=N2)C(=O)OC

InChI

InChI=1S/C17H25N3O4/c1-17(2,3)24-16(22)20-11-9-19(10-12-20)14(15(21)23-4)13-7-5-6-8-18-13/h5-8,14H,9-12H2,1-4H3