chloranylethane; N-methyl-2-(4-nitrophenyl)ethanamine; hydrochloride

Systemtic Name: chloranylethane; N-methyl-2-(4-nitrophenyl)ethanamine; hydrochloride Openeye Name: chloroethane; N-methyl-2-(4-nitrophenyl)ethanamine; hydrochloride CAS Name: chloroethane; N-methyl-2-(4-nitrophenyl)ethanamine; hydrochloride IUPAC Name: chloroethane; N-methyl-2-(4-nitrophenyl)ethanamine; hydrochloride Traditional Name: chloroethane; methyl-[2-(4-nitrophenyl)ethyl]amine; hydrochloride Formula: C11H18Cl2N2O2 MolecularWeight: 281.17882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCl.CNCCC1=CC=C(C=C1)[N+](=O)[O-].Cl

Isomeric SMILES

CCCl.CNCCC1=CC=C(C=C1)[N+](=O)[O-].Cl

InChI

InChI=1S/C9H12N2O2.C2H5Cl.ClH/c1-10-7-6-8-2-4-9(5-3-8)11(12)13;1-2-3;/h2-5,10H,6-7H2,1H3;2H2,1H3;1H