ethyl 7-[4-[(2,3-dimethoxy-4-oxidanyl-phenyl)methyl]piperazin-1-yl]heptanoate

Systemtic Name: ethyl 7-[4-[(2,3-dimethoxy-4-oxidanyl-phenyl)methyl]piperazin-1-yl]heptanoate Openeye Name: ethyl 7-[4-[(4-hydroxy-2,3-dimethoxy-phenyl)methyl]piperazin-1-yl]heptanoate CAS Name: 7-[4-[(4-hydroxy-2,3-dimethoxyphenyl)methyl]-1-piperazinyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[4-[(4-hydroxy-2,3-dimethoxyphenyl)methyl]piperazin-1-yl]heptanoate Traditional Name: 7-[4-(4-hydroxy-2,3-dimethoxy-benzyl)piperazino]enanthic acid ethyl ester Formula: C22H36N2O5 MolecularWeight: 408.53164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN1CCN(CC1)CC2=C(C(=C(C=C2)O)OC)OC

Isomeric SMILES

CCOC(=O)CCCCCCN1CCN(CC1)CC2=C(C(=C(C=C2)O)OC)OC

InChI

InChI=1S/C22H36N2O5/c1-4-29-20(26)9-7-5-6-8-12-23-13-15-24(16-14-23)17-18-10-11-19(25)22(28-3)21(18)27-2/h10-11,25H,4-9,12-17H2,1-3H3