methyl 2-[methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]amino]ethanoate

Systemtic Name: methyl 2-[methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]amino]ethanoate Openeye Name: methyl 2-[methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]amino]acetate CAS Name: 2-[methyl-[5-nitro-6-(propylamino)-4-pyrimidinyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]amino]acetate Traditional Name: 2-[methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]amino]acetic acid methyl ester Formula: C11H17N5O4 MolecularWeight: 283.28378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=NC=N1)N(C)CC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C(=NC=N1)N(C)CC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H17N5O4/c1-4-5-12-10-9(16(18)19)11(14-7-13-10)15(2)6-8(17)20-3/h7H,4-6H2,1-3H3,(H,12,13,14)