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

Systemtic Name: (E)-3-[4-(2-methylpropanoylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-methylpropanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-methylpropanoylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(isobutyrylamino)phenyl]acrylic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-9(2)13(17)14-11-6-3-10(4-7-11)5-8-12(15)16/h3-9H,1-2H3,(H,14,17)(H,15,16)/b8-5+