7-[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-2,3-dimethoxy-phenoxy]heptanoic acid

Systemtic Name: 7-[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-2,3-dimethoxy-phenoxy]heptanoic acid Openeye Name: 7-[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-2,3-dimethoxy-phenoxy]heptanoic acid CAS Name: 7-[6-[[4-(cyclopropylmethyl)-1-piperazinyl]methyl]-2,3-dimethoxyphenoxy]heptanoic acid IUPAC Name: 7-[6-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-2,3-dimethoxyphenoxy]heptanoic acid Traditional Name: 7-[6-[[4-(cyclopropylmethyl)piperazino]methyl]-2,3-dimethoxy-phenoxy]enanthic acid Formula: C24H38N2O5 MolecularWeight: 434.56892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3CC3)OCCCCCCC(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3CC3)OCCCCCCC(=O)O)OC

InChI

InChI=1S/C24H38N2O5/c1-29-21-11-10-20(18-26-14-12-25(13-15-26)17-19-8-9-19)23(24(21)30-2)31-16-6-4-3-5-7-22(27)28/h10-11,19H,3-9,12-18H2,1-2H3,(H,27,28)