ethyl 4-[3-(3-methylphenoxy)-2-oxidanyl-propyl]piperazine-1-carboxylate hydrochloride

Systemtic Name: ethyl 4-[3-(3-methylphenoxy)-2-oxidanyl-propyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[2-hydroxy-3-(3-methylphenoxy)propyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C17H27ClN2O4 MolecularWeight: 358.86028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O4.ClH/c1-3-22-17(21)19-9-7-18(8-10-19)12-15(20)13-23-16-6-4-5-14(2)11-16;/h4-6,11,15,20H,3,7-10,12-13H2,1-2H3;1H