N-[(3,5-dimethylphenyl)methyl]-1-[4-[(4-ethynylphenyl)methoxy]phenyl]methanamine

Systemtic Name: N-[(3,5-dimethylphenyl)methyl]-1-[4-[(4-ethynylphenyl)methoxy]phenyl]methanamine Openeye Name: N-[(3,5-dimethylphenyl)methyl]-1-[4-[(4-ethynylphenyl)methoxy]phenyl]methanamine CAS Name: N-[(3,5-dimethylphenyl)methyl]-1-[4-[(4-ethynylphenyl)methoxy]phenyl]methanamine IUPAC Name: N-[(3,5-dimethylphenyl)methyl]-1-[4-[(4-ethynylphenyl)methoxy]phenyl]methanamine Traditional Name: (3,5-dimethylbenzyl)-[4-(4-ethynylbenzyl)oxybenzyl]amine Formula: C25H25NO MolecularWeight: 355.4721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CNCC2=CC=C(C=C2)OCC3=CC=C(C=C3)C#C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CNCC2=CC=C(C=C2)OCC3=CC=C(C=C3)C#C)C

InChI

InChI=1S/C25H25NO/c1-4-21-5-7-23(8-6-21)18-27-25-11-9-22(10-12-25)16-26-17-24-14-19(2)13-20(3)15-24/h1,5-15,26H,16-18H2,2-3H3