tert-butyl 2-[methyl-[6-[methyl-(1-methylpiperidin-4-yl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanoate

Systemtic Name: tert-butyl 2-[methyl-[6-[methyl-(1-methylpiperidin-4-yl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanoate Openeye Name: tert-butyl 2-[methyl-[6-[methyl-(1-methyl-4-piperidyl)amino]-5-nitro-pyrimidin-4-yl]amino]acetate CAS Name: 2-[methyl-[6-[methyl-(1-methyl-4-piperidinyl)amino]-5-nitro-4-pyrimidinyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[methyl-[6-[methyl-(1-methylpiperidin-4-yl)amino]-5-nitropyrimidin-4-yl]amino]acetate Traditional Name: 2-[methyl-[6-[methyl-(1-methyl-4-piperidyl)amino]-5-nitro-pyrimidin-4-yl]amino]acetic acid tert-butyl ester Formula: C18H30N6O4 MolecularWeight: 394.4686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C)C1=NC=NC(=C1[N+](=O)[O-])N(C)C2CCN(CC2)C

Isomeric SMILES

CC(C)(C)OC(=O)CN(C)C1=NC=NC(=C1[N+](=O)[O-])N(C)C2CCN(CC2)C

InChI

InChI=1S/C18H30N6O4/c1-18(2,3)28-14(25)11-22(5)16-15(24(26)27)17(20-12-19-16)23(6)13-7-9-21(4)10-8-13/h12-13H,7-11H2,1-6H3