3-[[(E)-2-methylpent-2-enoyl]amino]benzoate

Systemtic Name: 3-[[(E)-2-methylpent-2-enoyl]amino]benzoate Openeye Name: 3-[[(E)-2-methylpent-2-enoyl]amino]benzoate CAS Name: 3-[[(E)-2-methyl-1-oxopent-2-enyl]amino]benzoate IUPAC Name: 3-[[(E)-2-methylpent-2-enoyl]amino]benzoate Traditional Name: 3-[[(E)-2-methylpent-2-enoyl]amino]benzoate Formula: C13H14NO3- MolecularWeight: 232.25516

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C)C(=O)NC1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CC/C=C(\C)/C(=O)NC1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C13H15NO3/c1-3-5-9(2)12(15)14-11-7-4-6-10(8-11)13(16)17/h4-8H,3H2,1-2H3,(H,14,15)(H,16,17)/p-1/b9-5+