(E)-3-[4-(2-acetamidopropanoylamino)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-acetamidopropanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-acetamidopropanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(2-acetamido-1-oxopropyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-acetamidopropanoylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-acetamidopropanoylamino)phenyl]acrylic acid Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O4/c1-9(15-10(2)17)14(20)16-12-6-3-11(4-7-12)5-8-13(18)19/h3-9H,1-2H3,(H,15,17)(H,16,20)(H,18,19)/b8-5+