(2E)-2-[3-(3-methylphenyl)prop-2-ynoxyimino]propanoic acid

Systemtic Name: (2E)-2-[3-(3-methylphenyl)prop-2-ynoxyimino]propanoic acid Openeye Name: (2E)-2-[3-(m-tolyl)prop-2-ynoxyimino]propanoic acid CAS Name: (2E)-2-[3-(3-methylphenyl)prop-2-ynoxyimino]propanoic acid IUPAC Name: (2E)-2-[3-(3-methylphenyl)prop-2-ynoxyimino]propanoic acid Traditional Name: (2E)-2-[3-(m-tolyl)prop-2-ynyloximino]propionic acid Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C#CCON=C(C)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C#CCO/N=C(\C)/C(=O)O

InChI

InChI=1S/C13H13NO3/c1-10-5-3-6-12(9-10)7-4-8-17-14-11(2)13(15)16/h3,5-6,9H,8H2,1-2H3,(H,15,16)/b14-11+