ethyl 4-[3-(1,3-benzodioxol-5-yloxy)-2-oxidanyl-propyl]piperazine-1-carboxylate hydrochloride

Systemtic Name: ethyl 4-[3-(1,3-benzodioxol-5-yloxy)-2-oxidanyl-propyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[3-(1,3-benzodioxol-5-yloxy)-2-hydroxy-propyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[3-(1,3-benzodioxol-5-yloxy)-2-hydroxypropyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[3-(1,3-benzodioxol-5-yloxy)-2-hydroxypropyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[3-(1,3-benzodioxol-5-yloxy)-2-hydroxy-propyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C17H25ClN2O6 MolecularWeight: 388.8432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(COC2=CC3=C(C=C2)OCO3)O.Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(COC2=CC3=C(C=C2)OCO3)O.Cl

InChI

InChI=1S/C17H24N2O6.ClH/c1-2-22-17(21)19-7-5-18(6-8-19)10-13(20)11-23-14-3-4-15-16(9-14)25-12-24-15;/h3-4,9,13,20H,2,5-8,10-12H2,1H3;1H