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5-azanyl-2-[bis(2-chloroethyl)amino]benzenecarbonitrile hydrochloride

5-azanyl-2-[bis(2-chloroethyl)amino]benzenecarbonitrile hydrochloride

Systemtic Name:5-azanyl-2-[bis(2-chloroethyl)amino]benzenecarbonitrile hydrochloride
Openeye Name:5-amino-2-[bis(2-chloroethyl)amino]benzonitrile hydrochloride
CAS Name:5-amino-2-[bis(2-chloroethyl)amino]benzonitrile hydrochloride
IUPAC Name:5-amino-2-[bis(2-chloroethyl)amino]benzonitrile hydrochloride
Traditional Name:5-amino-2-[bis(2-chloroethyl)amino]benzonitrile hydrochloride
Formula: C11H14Cl3N3
MolecularWeight: 294.60796
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C#N)N(CCCl)CCCl.Cl


Isomeric SMILES

C1=CC(=C(C=C1N)C#N)N(CCCl)CCCl.Cl


InChI

InChI=1S/C11H13Cl2N3.ClH/c12-3-5-16(6-4-13)11-2-1-10(15)7-9(11)8-14;/h1-2,7H,3-6,15H2;1H


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