1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione Openeye Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione CAS Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-4-(4-ethoxyphenyl)butane-1,4-dione IUPAC Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(4-ethoxyphenyl)butane-1,4-dione Traditional Name: 1-[4-(2,5-dimethoxybenzyl)piperazino]-4-p-phenetyl-butane-1,4-dione Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C25H32N2O5/c1-4-32-21-7-5-19(6-8-21)23(28)10-12-25(29)27-15-13-26(14-16-27)18-20-17-22(30-2)9-11-24(20)31-3/h5-9,11,17H,4,10,12-16,18H2,1-3H3