(E)-4-[(3-chlorophenyl)methyl-ethyl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3-chlorophenyl)methyl-ethyl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(3-chlorophenyl)methyl-ethyl-amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(3-chlorophenyl)methyl-ethylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3-chlorophenyl)methyl-ethylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(3-chlorobenzyl)-ethyl-amino]-4-keto-but-2-enoic acid Formula: C13H14ClNO3 MolecularWeight: 267.70816

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)Cl)C(=O)C=CC(=O)O

Isomeric SMILES

CCN(CC1=CC(=CC=C1)Cl)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H14ClNO3/c1-2-15(12(16)6-7-13(17)18)9-10-4-3-5-11(14)8-10/h3-8H,2,9H2,1H3,(H,17,18)/b7-6+