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

Systemtic Name: ethyl 4-[3-(4-acetamidophenoxy)-2-oxidanyl-propyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[3-(4-acetamidophenoxy)-2-hydroxy-propyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[3-(4-acetamidophenoxy)-2-hydroxypropyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[3-(4-acetamidophenoxy)-2-hydroxypropyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[3-(4-acetamidophenoxy)-2-hydroxy-propyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C18H28ClN3O5 MolecularWeight: 401.88502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O5.ClH/c1-3-25-18(24)21-10-8-20(9-11-21)12-16(23)13-26-17-6-4-15(5-7-17)19-14(2)22;/h4-7,16,23H,3,8-13H2,1-2H3,(H,19,22);1H