4-[1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)aniline

Systemtic Name: 4-[1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)aniline Openeye Name: 4-[1,3-bis[(4-methoxyphenyl)methyl]hexahydropyrimidin-2-yl]-N,N-bis(2-chloroethyl)aniline CAS Name: 4-[1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)aniline IUPAC Name: 4-[1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)aniline Traditional Name: [4-[1,3-bis(p-anisyl)hexahydropyrimidin-2-yl]phenyl]-bis(2-chloroethyl)amine Formula: C30H37Cl2N3O2 MolecularWeight: 542.53968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(C2C3=CC=C(C=C3)N(CCCl)CCCl)CC4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(C2C3=CC=C(C=C3)N(CCCl)CCCl)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C30H37Cl2N3O2/c1-36-28-12-4-24(5-13-28)22-34-18-3-19-35(23-25-6-14-29(37-2)15-7-25)30(34)26-8-10-27(11-9-26)33(20-16-31)21-17-32/h4-15,30H,3,16-23H2,1-2H3