methyl 4-acetamido-2-prop-2-ynoxy-benzoate

Systemtic Name: methyl 4-acetamido-2-prop-2-ynoxy-benzoate Openeye Name: methyl 4-acetamido-2-prop-2-ynoxy-benzoate CAS Name: 4-acetamido-2-prop-2-ynoxybenzoic acid methyl ester IUPAC Name: methyl 4-acetamido-2-prop-2-ynoxybenzoate Traditional Name: 4-acetamido-2-propargyloxy-benzoic acid methyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)OC)OCC#C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)OC)OCC#C

InChI

InChI=1S/C13H13NO4/c1-4-7-18-12-8-10(14-9(2)15)5-6-11(12)13(16)17-3/h1,5-6,8H,7H2,2-3H3,(H,14,15)