ethyl 2-oxidanyl-4-[3-[(phenylmethyl)amino]propanoylamino]benzoate hydrochloride

Systemtic Name: ethyl 2-oxidanyl-4-[3-[(phenylmethyl)amino]propanoylamino]benzoate hydrochloride Openeye Name: ethyl 4-[3-(benzylamino)propanoylamino]-2-hydroxy-benzoate hydrochloride CAS Name: 2-hydroxy-4-[[1-oxo-3-[(phenylmethyl)amino]propyl]amino]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[3-(benzylamino)propanoylamino]-2-hydroxybenzoate hydrochloride Traditional Name: 4-[3-(benzylamino)propanoylamino]-2-hydroxy-benzoic acid ethyl ester hydrochloride Formula: C19H23ClN2O4 MolecularWeight: 378.84992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)NC(=O)CCNCC2=CC=CC=C2)O.Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)NC(=O)CCNCC2=CC=CC=C2)O.Cl

InChI

InChI=1S/C19H22N2O4.ClH/c1-2-25-19(24)16-9-8-15(12-17(16)22)21-18(23)10-11-20-13-14-6-4-3-5-7-14;/h3-9,12,20,22H,2,10-11,13H2,1H3,(H,21,23);1H