ethyl 4-[[6-[tert-butyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[6-[tert-butyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[6-[tert-butyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[6-[tert-butyl(methyl)amino]-5-nitro-4-pyrimidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[6-[tert-butyl(methyl)amino]-5-nitropyrimidin-4-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[6-[tert-butyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C17H28N6O4 MolecularWeight: 380.44202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=C(C(=NC=N2)N(C)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=C(C(=NC=N2)N(C)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H28N6O4/c1-6-27-16(24)22-9-7-12(8-10-22)20-14-13(23(25)26)15(19-11-18-14)21(5)17(2,3)4/h11-12H,6-10H2,1-5H3,(H,18,19,20)