4,5-dimethyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenol

Systemtic Name: 4,5-dimethyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenol Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-4,5-dimethyl-phenol CAS Name: 4,5-dimethyl-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenol IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-4,5-dimethylphenol Traditional Name: 2-[(4-benzylpiperazino)methyl]-4,5-dimethyl-phenol Formula: C20H26N2O MolecularWeight: 310.43324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1C)O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O/c1-16-12-19(20(23)13-17(16)2)15-22-10-8-21(9-11-22)14-18-6-4-3-5-7-18/h3-7,12-13,23H,8-11,14-15H2,1-2H3