methyl 2-[2-azanyl-6-[1-(6-chloranylpyridin-3-yl)propyl]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-azanyl-6-[1-(6-chloranylpyridin-3-yl)propyl]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]ethanoate Openeye Name: methyl 2-[2-amino-6-[1-(6-chloro-3-pyridyl)propyl]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]acetate CAS Name: 2-[2-amino-6-[1-(6-chloro-3-pyridinyl)propyl]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-amino-6-[1-(6-chloropyridin-3-yl)propyl]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]acetate Traditional Name: 2-[2-amino-6-[1-(6-chloro-3-pyridyl)propyl]-1-methyl-5-nitro-2,4-dihydropyrimidin-3-yl]acetic acid methyl ester Formula: C16H22ClN5O4 MolecularWeight: 383.82998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=C(C=C1)Cl)C2=C(CN(C(N2C)N)CC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CN=C(C=C1)Cl)C2=C(CN(C(N2C)N)CC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H22ClN5O4/c1-4-11(10-5-6-13(17)19-7-10)15-12(22(24)25)8-21(9-14(23)26-3)16(18)20(15)2/h5-7,11,16H,4,8-9,18H2,1-3H3