4-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(3,5-dimethoxyphenyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(3,5-dimethoxyphenyl)piperazino]-4-keto-butyric acid Formula: C16H22N2O5 MolecularWeight: 322.35628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5/c1-22-13-9-12(10-14(11-13)23-2)17-5-7-18(8-6-17)15(19)3-4-16(20)21/h9-11H,3-8H2,1-2H3,(H,20,21)