N1,N1-bis(2-chloroethyl)-2-methyl-benzene-1,4-diamine hydrochloride

Systemtic Name: N1,N1-bis(2-chloroethyl)-2-methyl-benzene-1,4-diamine hydrochloride Openeye Name: N1,N1-bis(2-chloroethyl)-2-methyl-benzene-1,4-diamine hydrochloride CAS Name: N1,N1-bis(2-chloroethyl)-2-methylbenzene-1,4-diamine hydrochloride IUPAC Name: 1-N,1-N-bis(2-chloroethyl)-2-methylbenzene-1,4-diamine hydrochloride Traditional Name: (4-amino-2-methyl-phenyl)-bis(2-chloroethyl)amine hydrochloride Formula: C11H17Cl3N2 MolecularWeight: 283.62508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)N(CCCl)CCCl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N)N(CCCl)CCCl.Cl

InChI

InChI=1S/C11H16Cl2N2.ClH/c1-9-8-10(14)2-3-11(9)15(6-4-12)7-5-13;/h2-3,8H,4-7,14H2,1H3;1H