(E)-3-[(4-ethylphenyl)methylamino]but-2-enoic acid

Systemtic Name: (E)-3-[(4-ethylphenyl)methylamino]but-2-enoic acid Openeye Name: (E)-3-[(4-ethylphenyl)methylamino]but-2-enoic acid CAS Name: (E)-3-[(4-ethylphenyl)methylamino]-2-butenoic acid IUPAC Name: (E)-3-[(4-ethylphenyl)methylamino]but-2-enoic acid Traditional Name: (E)-3-[(4-ethylbenzyl)amino]but-2-enoic acid Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=CC(=O)O)C

Isomeric SMILES

CCC1=CC=C(C=C1)CN/C(=C/C(=O)O)/C

InChI

InChI=1S/C13H17NO2/c1-3-11-4-6-12(7-5-11)9-14-10(2)8-13(15)16/h4-8,14H,3,9H2,1-2H3,(H,15,16)/b10-8+