4-[[(E)-but-2-enoyl]amino]-3-methyl-benzoate

Systemtic Name: 4-[[(E)-but-2-enoyl]amino]-3-methyl-benzoate Openeye Name: 4-[[(E)-but-2-enoyl]amino]-3-methyl-benzoate CAS Name: 3-methyl-4-[[(E)-1-oxobut-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-but-2-enoyl]amino]-3-methylbenzoate Traditional Name: 4-[[(E)-but-2-enoyl]amino]-3-methyl-benzoate Formula: C12H12NO3- MolecularWeight: 218.22858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c1-3-4-11(14)13-10-6-5-9(12(15)16)7-8(10)2/h3-7H,1-2H3,(H,13,14)(H,15,16)/p-1/b4-3+