4-methyl-3-(prop-2-ynoylamino)benzoate

Systemtic Name: 4-methyl-3-(prop-2-ynoylamino)benzoate Openeye Name: 4-methyl-3-(prop-2-ynoylamino)benzoate CAS Name: 4-methyl-3-(1-oxoprop-2-ynylamino)benzoate IUPAC Name: 4-methyl-3-(prop-2-ynoylamino)benzoate Traditional Name: 4-methyl-3-(propioloylamino)benzoate Formula: C11H8NO3- MolecularWeight: 202.18612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)C#C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)C#C

InChI

InChI=1S/C11H9NO3/c1-3-10(13)12-9-6-8(11(14)15)5-4-7(9)2/h1,4-6H,2H3,(H,12,13)(H,14,15)/p-1