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

Systemtic Name: N1,N1-bis(2-chloroethyl)-2-methoxy-benzene-1,4-diamine hydrochloride Openeye Name: N1,N1-bis(2-chloroethyl)-2-methoxy-benzene-1,4-diamine hydrochloride CAS Name: N1,N1-bis(2-chloroethyl)-2-methoxybenzene-1,4-diamine hydrochloride IUPAC Name: 1-N,1-N-bis(2-chloroethyl)-2-methoxybenzene-1,4-diamine hydrochloride Traditional Name: (4-amino-2-methoxy-phenyl)-bis(2-chloroethyl)amine hydrochloride Formula: C11H17Cl3N2O MolecularWeight: 299.62448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N)N(CCCl)CCCl.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)N)N(CCCl)CCCl.Cl

InChI

InChI=1S/C11H16Cl2N2O.ClH/c1-16-11-8-9(14)2-3-10(11)15(6-4-12)7-5-13;/h2-3,8H,4-7,14H2,1H3;1H