ethyl 5-[2,3-dimethoxy-6-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenoxy]pentanoate

Systemtic Name: ethyl 5-[2,3-dimethoxy-6-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenoxy]pentanoate Openeye Name: ethyl 5-[6-[(4-benzylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenoxy]pentanoate CAS Name: 5-[2,3-dimethoxy-6-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenoxy]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[6-[(4-benzylpiperazin-1-yl)methyl]-2,3-dimethoxyphenoxy]pentanoate Traditional Name: 5-[6-[(4-benzylpiperazino)methyl]-2,3-dimethoxy-phenoxy]valeric acid ethyl ester Formula: C27H38N2O5 MolecularWeight: 470.60102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCOC1=C(C=CC(=C1OC)OC)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCCOC1=C(C=CC(=C1OC)OC)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C27H38N2O5/c1-4-33-25(30)12-8-9-19-34-26-23(13-14-24(31-2)27(26)32-3)21-29-17-15-28(16-18-29)20-22-10-6-5-7-11-22/h5-7,10-11,13-14H,4,8-9,12,15-21H2,1-3H3