4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]aniline

Systemtic Name: 4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]aniline Openeye Name: 4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]aniline CAS Name: 4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]aniline IUPAC Name: 4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]aniline Traditional Name: [4-[4-(3,5-dimethylphenoxy)but-2-ynoxy]phenyl]amine Formula: C18H19NO2 MolecularWeight: 281.34896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC#CCOC2=CC=C(C=C2)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC#CCOC2=CC=C(C=C2)N)C

InChI

InChI=1S/C18H19NO2/c1-14-11-15(2)13-18(12-14)21-10-4-3-9-20-17-7-5-16(19)6-8-17/h5-8,11-13H,9-10,19H2,1-2H3