2-diethylaminoethyl 2-(4-decoxyphenyl)-2-oxidanyl-2-phenyl-ethanoate hydrochloride

Systemtic Name: 2-diethylaminoethyl 2-(4-decoxyphenyl)-2-oxidanyl-2-phenyl-ethanoate hydrochloride Openeye Name: 2-diethylaminoethyl 2-(4-decoxyphenyl)-2-hydroxy-2-phenyl-acetate hydrochloride CAS Name: 2-(4-decoxyphenyl)-2-hydroxy-2-phenylacetic acid 2-diethylaminoethyl ester hydrochloride IUPAC Name: 2-diethylaminoethyl 2-(4-decoxyphenyl)-2-hydroxy-2-phenylacetate hydrochloride Traditional Name: 2-(4-decoxyphenyl)-2-hydroxy-2-phenyl-acetic acid 2-diethylaminoethyl ester hydrochloride Formula: C30H46ClNO4 MolecularWeight: 520.14354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCCN(CC)CC)O.Cl

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCCN(CC)CC)O.Cl

InChI

InChI=1S/C30H45NO4.ClH/c1-4-7-8-9-10-11-12-16-24-34-28-21-19-27(20-22-28)30(33,26-17-14-13-15-18-26)29(32)35-25-23-31(5-2)6-3;/h13-15,17-22,33H,4-12,16,23-25H2,1-3H3;1H