O1-methyl O3-(phenylmethyl) 2-(aminomethyl)-2-azanyl-propanedioate hydrochloride

Systemtic Name: O1-methyl O3-(phenylmethyl) 2-(aminomethyl)-2-azanyl-propanedioate hydrochloride Openeye Name: O1-benzyl O3-methyl 2-amino-2-(aminomethyl)propanedioate hydrochloride CAS Name: 2-amino-2-(aminomethyl)propanedioic acid O1-methyl ester O3-(phenylmethyl) ester hydrochloride IUPAC Name: 3-O-benzyl 1-O-methyl 2-amino-2-(aminomethyl)propanedioate hydrochloride Traditional Name: 2-amino-2-(aminomethyl)malonic acid O1-benzyl ester O3-methyl ester hydrochloride Formula: C12H17ClN2O4 MolecularWeight: 288.72738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN)(C(=O)OCC1=CC=CC=C1)N.Cl

Isomeric SMILES

COC(=O)C(CN)(C(=O)OCC1=CC=CC=C1)N.Cl

InChI

InChI=1S/C12H16N2O4.ClH/c1-17-10(15)12(14,8-13)11(16)18-7-9-5-3-2-4-6-9;/h2-6H,7-8,13-14H2,1H3;1H