4-[1-(4-ethoxyphenyl)propan-2-yl-ethyl-amino]butyl 4-methoxybenzoate hydrochloride

Systemtic Name: 4-[1-(4-ethoxyphenyl)propan-2-yl-ethyl-amino]butyl 4-methoxybenzoate hydrochloride Openeye Name: 4-[[2-(4-ethoxyphenyl)-1-methyl-ethyl]-ethyl-amino]butyl 4-methoxybenzoate hydrochloride CAS Name: 4-methoxybenzoic acid 4-[1-(4-ethoxyphenyl)propan-2-yl-ethylamino]butyl ester hydrochloride IUPAC Name: 4-[1-(4-ethoxyphenyl)propan-2-yl-ethylamino]butyl 4-methoxybenzoate hydrochloride Traditional Name: 4-methoxybenzoic acid 4-[ethyl-(1-methyl-2-p-phenetyl-ethyl)amino]butyl ester hydrochloride Formula: C25H36ClNO4 MolecularWeight: 450.01064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO4.ClH/c1-5-26(20(3)19-21-9-13-24(14-10-21)29-6-2)17-7-8-18-30-25(27)22-11-15-23(28-4)16-12-22;/h9-16,20H,5-8,17-19H2,1-4H3;1H