1-[(6-chloranylpyridin-3-yl)methyl]-1-(2,2-dimethoxyethyl)-2-nitro-guanidine

Systemtic Name: 1-[(6-chloranylpyridin-3-yl)methyl]-1-(2,2-dimethoxyethyl)-2-nitro-guanidine Openeye Name: 1-[(6-chloro-3-pyridyl)methyl]-1-(2,2-dimethoxyethyl)-2-nitro-guanidine CAS Name: 1-[(6-chloro-3-pyridinyl)methyl]-1-(2,2-dimethoxyethyl)-2-nitroguanidine IUPAC Name: 1-[(6-chloropyridin-3-yl)methyl]-1-(2,2-dimethoxyethyl)-2-nitroguanidine Traditional Name: 1-[(6-chloro-3-pyridyl)methyl]-1-(2,2-dimethoxyethyl)-2-nitro-guanidine Formula: C11H16ClN5O4 MolecularWeight: 317.72884

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN(CC1=CN=C(C=C1)Cl)C(=N[N+](=O)[O-])N)OC

Isomeric SMILES

COC(CN(CC1=CN=C(C=C1)Cl)/C(=N/[N+](=O)[O-])/N)OC

InChI

InChI=1S/C11H16ClN5O4/c1-20-10(21-2)7-16(11(13)15-17(18)19)6-8-3-4-9(12)14-5-8/h3-5,10H,6-7H2,1-2H3,(H2,13,15)