ethyl 4-[5-[(1,3-benzodioxol-5-ylmethylamino)methyl]furan-2-yl]benzoate hydrochloride

Systemtic Name: ethyl 4-[5-[(1,3-benzodioxol-5-ylmethylamino)methyl]furan-2-yl]benzoate hydrochloride Openeye Name: ethyl 4-[5-[(1,3-benzodioxol-5-ylmethylamino)methyl]-2-furyl]benzoate hydrochloride CAS Name: 4-[5-[(1,3-benzodioxol-5-ylmethylamino)methyl]-2-furanyl]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[5-[(1,3-benzodioxol-5-ylmethylamino)methyl]furan-2-yl]benzoate hydrochloride Traditional Name: 4-[5-[(piperonylamino)methyl]-2-furyl]benzoic acid ethyl ester hydrochloride Formula: C22H22ClNO5 MolecularWeight: 415.86678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNCC3=CC4=C(C=C3)OCO4.Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNCC3=CC4=C(C=C3)OCO4.Cl

InChI

InChI=1S/C22H21NO5.ClH/c1-2-25-22(24)17-6-4-16(5-7-17)19-10-8-18(28-19)13-23-12-15-3-9-20-21(11-15)27-14-26-20;/h3-11,23H,2,12-14H2,1H3;1H