2-[8-(diethylamino)octyl]-3,4,5-trimethoxy-benzoate hydrochloride

Systemtic Name: 2-[8-(diethylamino)octyl]-3,4,5-trimethoxy-benzoate hydrochloride Openeye Name: 2-[8-(diethylamino)octyl]-3,4,5-trimethoxy-benzoate hydrochloride CAS Name: 2-[8-(diethylamino)octyl]-3,4,5-trimethoxybenzoate hydrochloride IUPAC Name: 2-[8-(diethylamino)octyl]-3,4,5-trimethoxybenzoate hydrochloride Traditional Name: 2-[8-(diethylamino)octyl]-3,4,5-trimethoxy-benzoate hydrochloride Formula: C22H37ClNO5- MolecularWeight: 430.98588

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCCCCCC1=C(C(=C(C=C1C(=O)[O-])OC)OC)OC.Cl

Isomeric SMILES

CCN(CC)CCCCCCCCC1=C(C(=C(C=C1C(=O)[O-])OC)OC)OC.Cl

InChI

InChI=1S/C22H37NO5.ClH/c1-6-23(7-2)15-13-11-9-8-10-12-14-17-18(22(24)25)16-19(26-3)21(28-5)20(17)27-4;/h16H,6-15H2,1-5H3,(H,24,25);1H/p-1