4-[[(2,4,5-trimethoxyphenyl)methylamino]methyl]benzoic acid hydrochloride

Systemtic Name: 4-[[(2,4,5-trimethoxyphenyl)methylamino]methyl]benzoic acid hydrochloride Openeye Name: 4-[[(2,4,5-trimethoxyphenyl)methylamino]methyl]benzoic acid hydrochloride CAS Name: 4-[[(2,4,5-trimethoxyphenyl)methylamino]methyl]benzoic acid hydrochloride IUPAC Name: 4-[[(2,4,5-trimethoxyphenyl)methylamino]methyl]benzoic acid hydrochloride Traditional Name: 4-[[(2,4,5-trimethoxybenzyl)amino]methyl]benzoic acid hydrochloride Formula: C18H22ClNO5 MolecularWeight: 367.82398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNCC2=CC=C(C=C2)C(=O)O)OC)OC.Cl

Isomeric SMILES

COC1=CC(=C(C=C1CNCC2=CC=C(C=C2)C(=O)O)OC)OC.Cl

InChI

InChI=1S/C18H21NO5.ClH/c1-22-15-9-17(24-3)16(23-2)8-14(15)11-19-10-12-4-6-13(7-5-12)18(20)21;/h4-9,19H,10-11H2,1-3H3,(H,20,21);1H