methyl 2-(prop-2-ynylamino)-1,3-benzoxazole-5-carboxylate

Systemtic Name: methyl 2-(prop-2-ynylamino)-1,3-benzoxazole-5-carboxylate Openeye Name: methyl 2-(prop-2-ynylamino)-1,3-benzoxazole-5-carboxylate CAS Name: 2-(prop-2-ynylamino)-1,3-benzoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(prop-2-ynylamino)-1,3-benzoxazole-5-carboxylate Traditional Name: 2-(propargylamino)-1,3-benzoxazole-5-carboxylic acid methyl ester Formula: C12H10N2O3 MolecularWeight: 230.2194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(=N2)NCC#C

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC(=N2)NCC#C

InChI

InChI=1S/C12H10N2O3/c1-3-6-13-12-14-9-7-8(11(15)16-2)4-5-10(9)17-12/h1,4-5,7H,6H2,2H3,(H,13,14)