3-(3,4-dimethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 3-(3,4-dimethoxyphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(3,4-dimethoxyphenyl)propan-1-one Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H28N2O3/c1-26-20-10-8-18(16-21(20)27-2)9-11-22(25)24-14-12-23(13-15-24)17-19-6-4-3-5-7-19/h3-8,10,16H,9,11-15,17H2,1-2H3