N-chloranyl-N-methyl-methanamine; 1-nitro-4-[(E)-2-nitroethenyl]benzene

Systemtic Name: N-chloranyl-N-methyl-methanamine; 1-nitro-4-[(E)-2-nitroethenyl]benzene Openeye Name: N-chloro-N-methyl-methanamine; 1-nitro-4-[(E)-2-nitrovinyl]benzene CAS Name: N-chloro-N-methylmethanamine; 1-nitro-4-[(E)-2-nitroethenyl]benzene IUPAC Name: N-chloro-N-methylmethanamine; 1-nitro-4-[(E)-2-nitroethenyl]benzene Traditional Name: chloro(dimethyl)amine; 1-nitro-4-[(E)-2-nitrovinyl]benzene Formula: C10H12ClN3O4 MolecularWeight: 273.67298

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)Cl.C1=CC(=CC=C1C=C[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)Cl.C1=CC(=CC=C1/C=C/[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H6N2O4.C2H6ClN/c11-9(12)6-5-7-1-3-8(4-2-7)10(13)14;1-4(2)3/h1-6H;1-2H3/b6-5+;