1-[4-(phenylmethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)propane-1,3-dione

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)propane-1,3-dione Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(3,4,5-trimethoxyphenyl)propane-1,3-dione CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)propane-1,3-dione IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(3,4,5-trimethoxyphenyl)propane-1,3-dione Traditional Name: 1-(4-benzylpiperazino)-3-(3,4,5-trimethoxyphenyl)propane-1,3-dione Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O5/c1-28-20-13-18(14-21(29-2)23(20)30-3)19(26)15-22(27)25-11-9-24(10-12-25)16-17-7-5-4-6-8-17/h4-8,13-14H,9-12,15-16H2,1-3H3