(E)-2-acetamido-3-(4-cyanophenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(4-cyanophenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(4-cyanophenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(4-cyanophenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(4-cyanophenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(4-cyanophenyl)acrylic acid Formula: C12H10N2O3 MolecularWeight: 230.2194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=C(C=C1)C#N)C(=O)O

Isomeric SMILES

CC(=O)N/C(=C/C1=CC=C(C=C1)C#N)/C(=O)O

InChI

InChI=1S/C12H10N2O3/c1-8(15)14-11(12(16)17)6-9-2-4-10(7-13)5-3-9/h2-6H,1H3,(H,14,15)(H,16,17)/b11-6+