ethanoic acid; methyl (Z)-3-phenylazanylbut-2-enoate

Systemtic Name: ethanoic acid; methyl (Z)-3-phenylazanylbut-2-enoate Openeye Name: acetic acid; methyl (Z)-3-anilinobut-2-enoate CAS Name: acetic acid; (Z)-3-anilino-2-butenoic acid methyl ester IUPAC Name: acetic acid; methyl (Z)-3-anilinobut-2-enoate Traditional Name: acetic acid; (Z)-3-anilinobut-2-enoic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC)NC1=CC=CC=C1.CC(=O)O

Isomeric SMILES

C/C(=C/C(=O)OC)/NC1=CC=CC=C1.CC(=O)O

InChI

InChI=1S/C11H13NO2.C2H4O2/c1-9(8-11(13)14-2)12-10-6-4-3-5-7-10;1-2(3)4/h3-8,12H,1-2H3;1H3,(H,3,4)/b9-8-;