2-(2,6-dimethylphenoxy)-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(2,6-dimethylphenoxy)-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(2,6-dimethylphenoxy)propan-1-one CAS Name: 2-(2,6-dimethylphenoxy)-1-[4-(diphenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(2,6-dimethylphenoxy)propan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-2-(2,6-dimethylphenoxy)propan-1-one Formula: C28H32N2O2 MolecularWeight: 428.56588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(C)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(C)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H32N2O2/c1-21-11-10-12-22(2)27(21)32-23(3)28(31)30-19-17-29(18-20-30)26(24-13-6-4-7-14-24)25-15-8-5-9-16-25/h4-16,23,26H,17-20H2,1-3H3