N,N-dimethyl-4-[(3-phenylmethoxyphenyl)-piperazin-1-yl-methyl]aniline

Systemtic Name: N,N-dimethyl-4-[(3-phenylmethoxyphenyl)-piperazin-1-yl-methyl]aniline Openeye Name: 4-[(3-benzyloxyphenyl)-piperazin-1-yl-methyl]-N,N-dimethyl-aniline CAS Name: N,N-dimethyl-4-[(3-phenylmethoxyphenyl)-(1-piperazinyl)methyl]aniline IUPAC Name: N,N-dimethyl-4-[(3-phenylmethoxyphenyl)-piperazin-1-ylmethyl]aniline Traditional Name: [4-[(3-benzoxyphenyl)-piperazino-methyl]phenyl]-dimethyl-amine Formula: C26H31N3O MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCNCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)N4CCNCC4

InChI

InChI=1S/C26H31N3O/c1-28(2)24-13-11-22(12-14-24)26(29-17-15-27-16-18-29)23-9-6-10-25(19-23)30-20-21-7-4-3-5-8-21/h3-14,19,26-27H,15-18,20H2,1-2H3