N-(2-chloroethyl)-N-methyl-3-(2-nitroimidazol-1-yl)propan-1-amine oxide

Systemtic Name: N-(2-chloroethyl)-N-methyl-3-(2-nitroimidazol-1-yl)propan-1-amine oxide Openeye Name: N-(2-chloroethyl)-N-methyl-3-(2-nitroimidazol-1-yl)propan-1-amine oxide CAS Name: N-(2-chloroethyl)-N-methyl-3-(2-nitro-1-imidazolyl)-1-propanamine oxide IUPAC Name: N-(2-chloroethyl)-N-methyl-3-(2-nitroimidazol-1-yl)propan-1-amine oxide Traditional Name: N-(2-chloroethyl)-N-methyl-3-(2-nitroimidazol-1-yl)propan-1-amine oxide Formula: C9H15ClN4O3 MolecularWeight: 262.6934

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCCN1C=CN=C1[N+](=O)[O-])(CCCl)[O-]

Isomeric SMILES

C[N+](CCCN1C=CN=C1[N+](=O)[O-])(CCCl)[O-]

InChI

InChI=1S/C9H15ClN4O3/c1-14(17,8-3-10)7-2-5-12-6-4-11-9(12)13(15)16/h4,6H,2-3,5,7-8H2,1H3