4-[[(3-methoxy-4-prop-2-enoxy-phenyl)methylamino]methyl]benzoic acid hydrochloride

Systemtic Name: 4-[[(3-methoxy-4-prop-2-enoxy-phenyl)methylamino]methyl]benzoic acid hydrochloride Openeye Name: 4-[[(4-allyloxy-3-methoxy-phenyl)methylamino]methyl]benzoic acid hydrochloride CAS Name: 4-[[(3-methoxy-4-prop-2-enoxyphenyl)methylamino]methyl]benzoic acid hydrochloride IUPAC Name: 4-[[(3-methoxy-4-prop-2-enoxyphenyl)methylamino]methyl]benzoic acid hydrochloride Traditional Name: 4-[[(4-allyloxy-3-methoxy-benzyl)amino]methyl]benzoic acid hydrochloride Formula: C19H22ClNO4 MolecularWeight: 363.83528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC2=CC=C(C=C2)C(=O)O)OCC=C.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC2=CC=C(C=C2)C(=O)O)OCC=C.Cl

InChI

InChI=1S/C19H21NO4.ClH/c1-3-10-24-17-9-6-15(11-18(17)23-2)13-20-12-14-4-7-16(8-5-14)19(21)22;/h3-9,11,20H,1,10,12-13H2,2H3,(H,21,22);1H