O1-ethyl O3-[(phenylmethyl)amino] 2-ethylpropanedioate hydrochloride

Systemtic Name: O1-ethyl O3-[(phenylmethyl)amino] 2-ethylpropanedioate hydrochloride Openeye Name: O1-(benzylamino) O3-ethyl 2-ethylpropanedioate hydrochloride CAS Name: 2-ethylpropanedioic acid O1-ethyl ester O3-[(phenylmethyl)amino] ester hydrochloride IUPAC Name: 1-O-(benzylamino) 3-O-ethyl 2-ethylpropanedioate hydrochloride Traditional Name: 2-ethylmalonic acid O1-(benzylamino) ester O3-ethyl ester hydrochloride Formula: C14H20ClNO4 MolecularWeight: 301.7659

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)C(=O)ONCC1=CC=CC=C1.Cl

Isomeric SMILES

CCC(C(=O)OCC)C(=O)ONCC1=CC=CC=C1.Cl

InChI

InChI=1S/C14H19NO4.ClH/c1-3-12(13(16)18-4-2)14(17)19-15-10-11-8-6-5-7-9-11;/h5-9,12,15H,3-4,10H2,1-2H3;1H