3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one

Systemtic Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one Openeye Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one CAS Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)-1-propanone IUPAC Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one Traditional Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one Formula: C14H19Cl2NO2 MolecularWeight: 304.21216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CCN(CCCl)CCCl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CCN(CCCl)CCCl

InChI

InChI=1S/C14H19Cl2NO2/c1-19-13-4-2-12(3-5-13)14(18)6-9-17(10-7-15)11-8-16/h2-5H,6-11H2,1H3