2-chloranyl-N-(2-chloroethyl)-N-[(2-ethoxy-5-nitro-phenyl)methyl]ethanamine hydrochloride

Systemtic Name: 2-chloranyl-N-(2-chloroethyl)-N-[(2-ethoxy-5-nitro-phenyl)methyl]ethanamine hydrochloride Openeye Name: 2-chloro-N-(2-chloroethyl)-N-[(2-ethoxy-5-nitro-phenyl)methyl]ethanamine hydrochloride CAS Name: 2-chloro-N-(2-chloroethyl)-N-[(2-ethoxy-5-nitrophenyl)methyl]ethanamine hydrochloride IUPAC Name: 2-chloro-N-(2-chloroethyl)-N-[(2-ethoxy-5-nitrophenyl)methyl]ethanamine hydrochloride Traditional Name: bis(2-chloroethyl)-(2-ethoxy-5-nitro-benzyl)amine hydrochloride Formula: C13H19Cl3N2O3 MolecularWeight: 357.66056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)[N+](=O)[O-])CN(CCCl)CCCl.Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)[N+](=O)[O-])CN(CCCl)CCCl.Cl

InChI

InChI=1S/C13H18Cl2N2O3.ClH/c1-2-20-13-4-3-12(17(18)19)9-11(13)10-16(7-5-14)8-6-15;/h3-4,9H,2,5-8,10H2,1H3;1H