3-ethynyl-N-[(4-propoxyphenyl)methyl]aniline

Systemtic Name: 3-ethynyl-N-[(4-propoxyphenyl)methyl]aniline Openeye Name: 3-ethynyl-N-[(4-propoxyphenyl)methyl]aniline CAS Name: 3-ethynyl-N-[(4-propoxyphenyl)methyl]aniline IUPAC Name: 3-ethynyl-N-[(4-propoxyphenyl)methyl]aniline Traditional Name: (3-ethynylphenyl)-(4-propoxybenzyl)amine Formula: C18H19NO MolecularWeight: 265.34956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CNC2=CC=CC(=C2)C#C

Isomeric SMILES

CCCOC1=CC=C(C=C1)CNC2=CC=CC(=C2)C#C

InChI

InChI=1S/C18H19NO/c1-3-12-20-18-10-8-16(9-11-18)14-19-17-7-5-6-15(4-2)13-17/h2,5-11,13,19H,3,12,14H2,1H3