2-[[(E)-3-(3-methylphenyl)prop-2-enoyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-3-(3-methylphenyl)prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(E)-3-(m-tolyl)prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(E)-3-(3-methylphenyl)-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(E)-3-(3-methylphenyl)prop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(E)-3-(m-tolyl)acryloyl]amino]acetic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC(=O)NCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C(=O)NCC(=O)O

InChI

InChI=1S/C12H13NO3/c1-9-3-2-4-10(7-9)5-6-11(14)13-8-12(15)16/h2-7H,8H2,1H3,(H,13,14)(H,15,16)/b6-5+