dimethyl (E)-3-[bis(2-chloroethyl)amino]pent-2-enedioate

Systemtic Name: dimethyl (E)-3-[bis(2-chloroethyl)amino]pent-2-enedioate Openeye Name: dimethyl (E)-3-[bis(2-chloroethyl)amino]pent-2-enedioate CAS Name: (E)-3-[bis(2-chloroethyl)amino]-2-pentenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-3-[bis(2-chloroethyl)amino]pent-2-enedioate Traditional Name: (E)-3-[bis(2-chloroethyl)amino]pent-2-enedioic acid dimethyl ester Formula: C11H17Cl2NO4 MolecularWeight: 298.16298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=CC(=O)OC)N(CCCl)CCCl

Isomeric SMILES

COC(=O)C/C(=C\C(=O)OC)/N(CCCl)CCCl

InChI

InChI=1S/C11H17Cl2NO4/c1-17-10(15)7-9(8-11(16)18-2)14(5-3-12)6-4-13/h7H,3-6,8H2,1-2H3/b9-7+