2-azanyl-3-(4-phenylmethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-azanyl-3-(4-phenylmethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 2-amino-3-(4-benzyloxyphenyl)-1-(4-benzylpiperazin-1-yl)propan-1-one CAS Name: 2-amino-3-(4-phenylmethoxyphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-amino-1-(4-benzylpiperazin-1-yl)-3-(4-phenylmethoxyphenyl)propan-1-one Traditional Name: 2-amino-3-(4-benzoxyphenyl)-1-(4-benzylpiperazino)propan-1-one Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C(CC3=CC=C(C=C3)OCC4=CC=CC=C4)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C(CC3=CC=C(C=C3)OCC4=CC=CC=C4)N

InChI

InChI=1S/C27H31N3O2/c28-26(19-22-11-13-25(14-12-22)32-21-24-9-5-2-6-10-24)27(31)30-17-15-29(16-18-30)20-23-7-3-1-4-8-23/h1-14,26H,15-21,28H2