4-(3-azanylpropyl)-N,N-bis(2-chloroethyl)aniline

Systemtic Name: 4-(3-azanylpropyl)-N,N-bis(2-chloroethyl)aniline Openeye Name: 4-(3-aminopropyl)-N,N-bis(2-chloroethyl)aniline CAS Name: 4-(3-aminopropyl)-N,N-bis(2-chloroethyl)aniline IUPAC Name: 4-(3-aminopropyl)-N,N-bis(2-chloroethyl)aniline Traditional Name: [4-(3-aminopropyl)phenyl]-bis(2-chloroethyl)amine Formula: C13H20Cl2N2 MolecularWeight: 275.2173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCN)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1CCCN)N(CCCl)CCCl

InChI

InChI=1S/C13H20Cl2N2/c14-7-10-17(11-8-15)13-5-3-12(4-6-13)2-1-9-16/h3-6H,1-2,7-11,16H2