N1-(2-chloroethyl)-N2-pentyl-but-3-yne-1,2-diamine

Systemtic Name: N1-(2-chloroethyl)-N2-pentyl-but-3-yne-1,2-diamine Openeye Name: N1-(2-chloroethyl)-N2-pentyl-but-3-yne-1,2-diamine CAS Name: N1-(2-chloroethyl)-N2-pentyl-3-butyne-1,2-diamine IUPAC Name: 1-N-(2-chloroethyl)-2-N-pentylbut-3-yne-1,2-diamine Traditional Name: amyl-[1-[(2-chloroethylamino)methyl]prop-2-ynyl]amine Formula: C11H21ClN2 MolecularWeight: 216.75084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(CNCCCl)C#C

Isomeric SMILES

CCCCCNC(CNCCCl)C#C

InChI

InChI=1S/C11H21ClN2/c1-3-5-6-8-14-11(4-2)10-13-9-7-12/h2,11,13-14H,3,5-10H2,1H3