ethyl 4-[[2-[3-(dimethylamino)-2-oxidanyl-propoxy]-5-methoxy-phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[3-(dimethylamino)-2-oxidanyl-propoxy]-5-methoxy-phenyl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[2-[3-(dimethylamino)-2-hydroxy-propoxy]-5-methoxy-phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[2-[3-(dimethylamino)-2-hydroxypropoxy]-5-methoxyphenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-(dimethylamino)-2-hydroxypropoxy]-5-methoxyphenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-(dimethylamino)-2-hydroxy-propoxy]-5-methoxy-benzyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H33N3O5 MolecularWeight: 395.49312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=C(C=CC(=C2)OC)OCC(CN(C)C)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=C(C=CC(=C2)OC)OCC(CN(C)C)O

InChI

InChI=1S/C20H33N3O5/c1-5-27-20(25)23-10-8-22(9-11-23)13-16-12-18(26-4)6-7-19(16)28-15-17(24)14-21(2)3/h6-7,12,17,24H,5,8-11,13-15H2,1-4H3