4-[2,3-dimethoxy-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenoxy]butanoic acid

Systemtic Name: 4-[2,3-dimethoxy-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenoxy]butanoic acid Openeye Name: 4-[2,3-dimethoxy-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenoxy]butanoic acid CAS Name: 4-[2,3-dimethoxy-6-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]phenoxy]butanoic acid IUPAC Name: 4-[2,3-dimethoxy-6-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenoxy]butanoic acid Traditional Name: 4-[2,3-dimethoxy-6-[[4-(2-methoxyphenyl)piperazino]methyl]phenoxy]butyric acid Formula: C24H32N2O6 MolecularWeight: 444.52068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C3=CC=CC=C3OC)OCCCC(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C3=CC=CC=C3OC)OCCCC(=O)O)OC

InChI

InChI=1S/C24H32N2O6/c1-29-20-8-5-4-7-19(20)26-14-12-25(13-15-26)17-18-10-11-21(30-2)24(31-3)23(18)32-16-6-9-22(27)28/h4-5,7-8,10-11H,6,9,12-17H2,1-3H3,(H,27,28)