benzenecarbonitrile; N,N-bis(2-chloroethyl)nitramide

Systemtic Name: benzenecarbonitrile; N,N-bis(2-chloroethyl)nitramide Openeye Name: benzonitrile; N,N-bis(2-chloroethyl)nitramide CAS Name: benzonitrile; N,N-bis(2-chloroethyl)nitramide IUPAC Name: benzonitrile; N,N-bis(2-chloroethyl)nitramide Traditional Name: benzonitrile; N,N-bis(2-chloroethyl)nitramide Formula: C11H13Cl2N3O2 MolecularWeight: 290.14582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#N.C(CCl)N(CCCl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#N.C(CCl)N(CCCl)[N+](=O)[O-]

InChI

InChI=1S/C7H5N.C4H8Cl2N2O2/c8-6-7-4-2-1-3-5-7;5-1-3-7(4-2-6)8(9)10/h1-5H;1-4H2