2-chloranyl-N-(2-chloroethyl)ethanamine; (E)-3-phenylprop-2-enoic acid

Systemtic Name: 2-chloranyl-N-(2-chloroethyl)ethanamine; (E)-3-phenylprop-2-enoic acid Openeye Name: 2-chloro-N-(2-chloroethyl)ethanamine; (E)-3-phenylprop-2-enoic acid CAS Name: 2-chloro-N-(2-chloroethyl)ethanamine; (E)-3-phenyl-2-propenoic acid IUPAC Name: 2-chloro-N-(2-chloroethyl)ethanamine; (E)-3-phenylprop-2-enoic acid Traditional Name: bis(2-chloroethyl)amine; (E)-3-phenylacrylic acid Formula: C13H17Cl2NO2 MolecularWeight: 290.18558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)O.C(CCl)NCCCl

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)O.C(CCl)NCCCl

InChI

InChI=1S/C9H8O2.C4H9Cl2N/c10-9(11)7-6-8-4-2-1-3-5-8;5-1-3-7-4-2-6/h1-7H,(H,10,11);7H,1-4H2/b7-6+;