(E)-4-oxidanyl-2-(1-phenylazanylethyl)pent-2-enoic acid

Systemtic Name: (E)-4-oxidanyl-2-(1-phenylazanylethyl)pent-2-enoic acid Openeye Name: (E)-2-(1-anilinoethyl)-4-hydroxy-pent-2-enoic acid CAS Name: (E)-2-(1-anilinoethyl)-4-hydroxy-2-pentenoic acid IUPAC Name: (E)-2-(1-anilinoethyl)-4-hydroxypent-2-enoic acid Traditional Name: (E)-2-(1-anilinoethyl)-4-hydroxy-pent-2-enoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C(C(C)NC1=CC=CC=C1)C(=O)O)O

Isomeric SMILES

CC(/C=C(\C(C)NC1=CC=CC=C1)/C(=O)O)O

InChI

InChI=1S/C13H17NO3/c1-9(15)8-12(13(16)17)10(2)14-11-6-4-3-5-7-11/h3-10,14-15H,1-2H3,(H,16,17)/b12-8+