2-[[4-[bis(2-chloroethyl)amino]-3-methoxy-phenyl]methylidene]propanedinitrile

Systemtic Name: 2-[[4-[bis(2-chloroethyl)amino]-3-methoxy-phenyl]methylidene]propanedinitrile Openeye Name: 2-[[4-[bis(2-chloroethyl)amino]-3-methoxy-phenyl]methylene]propanedinitrile CAS Name: 2-[[4-[bis(2-chloroethyl)amino]-3-methoxyphenyl]methylidene]propanedinitrile IUPAC Name: 2-[[4-[bis(2-chloroethyl)amino]-3-methoxyphenyl]methylidene]propanedinitrile Traditional Name: 2-[4-[bis(2-chloroethyl)amino]-3-methoxy-benzylidene]malononitrile Formula: C15H15Cl2N3O MolecularWeight: 324.2051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C#N)N(CCCl)CCCl

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C#N)N(CCCl)CCCl

InChI

InChI=1S/C15H15Cl2N3O/c1-21-15-9-12(8-13(10-18)11-19)2-3-14(15)20(6-4-16)7-5-17/h2-3,8-9H,4-7H2,1H3