methyl 2-(prop-2-ynylcarbamoylamino)benzoate

Systemtic Name: methyl 2-(prop-2-ynylcarbamoylamino)benzoate Openeye Name: methyl 2-(prop-2-ynylcarbamoylamino)benzoate CAS Name: 2-[[oxo-(prop-2-ynylamino)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-(prop-2-ynylcarbamoylamino)benzoate Traditional Name: 2-(propargylcarbamoylamino)benzoic acid methyl ester Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)NCC#C

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)NCC#C

InChI

InChI=1S/C12H12N2O3/c1-3-8-13-12(16)14-10-7-5-4-6-9(10)11(15)17-2/h1,4-7H,8H2,2H3,(H2,13,14,16)