N-acridin-9-yl-N',N'-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride

Systemtic Name: N-acridin-9-yl-N',N'-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride Openeye Name: N-acridin-9-yl-N',N'-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride CAS Name: N-(9-acridinyl)-N',N'-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride IUPAC Name: N-acridin-9-yl-N',N'-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride Traditional Name: 3-(acridin-9-ylamino)propyl-bis(2-chloroethyl)amine dihydrochloride Formula: C20H25Cl4N3 MolecularWeight: 449.2446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCN(CCCl)CCCl.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCN(CCCl)CCCl.Cl.Cl

InChI

InChI=1S/C20H23Cl2N3.2ClH/c21-10-14-25(15-11-22)13-5-12-23-20-16-6-1-3-8-18(16)24-19-9-4-2-7-17(19)20;;/h1-4,6-9H,5,10-15H2,(H,23,24);2*1H