ethyl (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-acrylic acid ethyl ester Formula: C16H18Cl2N2O2 MolecularWeight: 341.23232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)N(CCCl)CCCl)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)N(CCCl)CCCl)/C#N

InChI

InChI=1S/C16H18Cl2N2O2/c1-2-22-16(21)14(12-19)11-13-3-5-15(6-4-13)20(9-7-17)10-8-18/h3-6,11H,2,7-10H2,1H3/b14-11+