2-diethylaminoethyl 2-[4-(3-methylbutoxy)phenyl]-2-oxidanyl-2-phenyl-ethanoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 2-[4-(3-methylbutoxy)phenyl]-2-oxidanyl-2-phenyl-ethanoate hydrochloride Openeye Name: 2-diethylaminoethyl 2-hydroxy-2-(4-isopentyloxyphenyl)-2-phenyl-acetate hydrochloride CAS Name: 2-hydroxy-2-[4-(3-methylbutoxy)phenyl]-2-phenylacetic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 2-hydroxy-2-[4-(3-methylbutoxy)phenyl]-2-phenylacetate hydrochloride Traditional Name: 2-hydroxy-2-(4-isoamoxyphenyl)-2-phenyl-acetic acid 2-diethylaminoethyl ester hydrochloride Formula: C25H36ClNO4 MolecularWeight: 450.01064

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=C(C=C2)OCCC(C)C)O.Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=C(C=C2)OCCC(C)C)O.Cl

InChI

InChI=1S/C25H35NO4.ClH/c1-5-26(6-2)17-19-30-24(27)25(28,21-10-8-7-9-11-21)22-12-14-23(15-13-22)29-18-16-20(3)4;/h7-15,20,28H,5-6,16-19H2,1-4H3;1H