methyl 4-[(prop-2-ynylamino)methyl]benzoate

Systemtic Name: methyl 4-[(prop-2-ynylamino)methyl]benzoate Openeye Name: methyl 4-[(prop-2-ynylamino)methyl]benzoate CAS Name: 4-[(prop-2-ynylamino)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(prop-2-ynylamino)methyl]benzoate Traditional Name: 4-[(propargylamino)methyl]benzoic acid methyl ester Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNCC#C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNCC#C

InChI

InChI=1S/C12H13NO2/c1-3-8-13-9-10-4-6-11(7-5-10)12(14)15-2/h1,4-7,13H,8-9H2,2H3