methyl 4-[2-[ethyl-(2-oxidanyl-2-phenyl-ethyl)amino]propyl]benzoate hydrochloride

Systemtic Name: methyl 4-[2-[ethyl-(2-oxidanyl-2-phenyl-ethyl)amino]propyl]benzoate hydrochloride Openeye Name: methyl 4-[2-[ethyl-(2-hydroxy-2-phenyl-ethyl)amino]propyl]benzoate hydrochloride CAS Name: 4-[2-[ethyl-(2-hydroxy-2-phenylethyl)amino]propyl]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[2-[ethyl-(2-hydroxy-2-phenylethyl)amino]propyl]benzoate hydrochloride Traditional Name: 4-[2-[ethyl-(2-hydroxy-2-phenyl-ethyl)amino]propyl]benzoic acid methyl ester hydrochloride Formula: C21H28ClNO3 MolecularWeight: 377.90492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(C1=CC=CC=C1)O)C(C)CC2=CC=C(C=C2)C(=O)OC.Cl

Isomeric SMILES

CCN(CC(C1=CC=CC=C1)O)C(C)CC2=CC=C(C=C2)C(=O)OC.Cl

InChI

InChI=1S/C21H27NO3.ClH/c1-4-22(15-20(23)18-8-6-5-7-9-18)16(2)14-17-10-12-19(13-11-17)21(24)25-3;/h5-13,16,20,23H,4,14-15H2,1-3H3;1H