(3-oxidanylidene-1H-2-benzofuran-1-yl) 4-(aminomethyl)cyclohexane-1-carboxylate hydrochloride

Systemtic Name: (3-oxidanylidene-1H-2-benzofuran-1-yl) 4-(aminomethyl)cyclohexane-1-carboxylate hydrochloride Openeye Name: (3-oxo-1H-isobenzofuran-1-yl) 4-(aminomethyl)cyclohexanecarboxylate hydrochloride CAS Name: 4-(aminomethyl)-1-cyclohexanecarboxylic acid (3-oxo-1H-isobenzofuran-1-yl) ester hydrochloride IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) 4-(aminomethyl)cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-(aminomethyl)cyclohexanecarboxylic acid phthalidyl ester hydrochloride Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)OC2C3=CC=CC=C3C(=O)O2.Cl

Isomeric SMILES

C1CC(CCC1CN)C(=O)OC2C3=CC=CC=C3C(=O)O2.Cl

InChI

InChI=1S/C16H19NO4.ClH/c17-9-10-5-7-11(8-6-10)14(18)20-16-13-4-2-1-3-12(13)15(19)21-16;/h1-4,10-11,16H,5-9,17H2;1H