N-[(3,5-dimethoxyphenyl)methyl]-3-ethynyl-aniline

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-3-ethynyl-aniline Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-3-ethynyl-aniline CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-3-ethynylaniline IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-3-ethynylaniline Traditional Name: (3,5-dimethoxybenzyl)-(3-ethynylphenyl)amine Formula: C17H17NO2 MolecularWeight: 267.32238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC2=CC=CC(=C2)C#C)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC2=CC=CC(=C2)C#C)OC

InChI

InChI=1S/C17H17NO2/c1-4-13-6-5-7-15(8-13)18-12-14-9-16(19-2)11-17(10-14)20-3/h1,5-11,18H,12H2,2-3H3