N-[(2,4,5-trimethoxyphenyl)methyl]prop-2-yn-1-amine

Systemtic Name: N-[(2,4,5-trimethoxyphenyl)methyl]prop-2-yn-1-amine Openeye Name: N-[(2,4,5-trimethoxyphenyl)methyl]prop-2-yn-1-amine CAS Name: N-[(2,4,5-trimethoxyphenyl)methyl]-2-propyn-1-amine IUPAC Name: N-[(2,4,5-trimethoxyphenyl)methyl]prop-2-yn-1-amine Traditional Name: propargyl-(2,4,5-trimethoxybenzyl)amine Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNCC#C)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNCC#C)OC)OC

InChI

InChI=1S/C13H17NO3/c1-5-6-14-9-10-7-12(16-3)13(17-4)8-11(10)15-2/h1,7-8,14H,6,9H2,2-4H3