(E)-4-[bis(2-chloroethyl)amino]but-3-en-2-one

Systemtic Name: (E)-4-[bis(2-chloroethyl)amino]but-3-en-2-one Openeye Name: (E)-4-[bis(2-chloroethyl)amino]but-3-en-2-one CAS Name: (E)-4-[bis(2-chloroethyl)amino]-3-buten-2-one IUPAC Name: (E)-4-[bis(2-chloroethyl)amino]but-3-en-2-one Traditional Name: (E)-4-[bis(2-chloroethyl)amino]but-3-en-2-one Formula: C8H13Cl2NO MolecularWeight: 210.10092

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CN(CCCl)CCCl

Isomeric SMILES

CC(=O)/C=C/N(CCCl)CCCl

InChI

InChI=1S/C8H13Cl2NO/c1-8(12)2-5-11(6-3-9)7-4-10/h2,5H,3-4,6-7H2,1H3/b5-2+