methyl-[2-oxidanyl-3-[4-(propylamino)phenyl]carbonyloxy-propyl]azanium chloride

Systemtic Name: methyl-[2-oxidanyl-3-[4-(propylamino)phenyl]carbonyloxy-propyl]azanium chloride Openeye Name: [2-hydroxy-3-[4-(propylamino)benzoyl]oxy-propyl]-methyl-ammonium chloride CAS Name: [2-hydroxy-3-[oxo-[4-(propylamino)phenyl]methoxy]propyl]-methylammonium chloride IUPAC Name: [2-hydroxy-3-[4-(propylamino)benzoyl]oxypropyl]-methylazanium chloride Traditional Name: [2-hydroxy-3-[4-(propylamino)benzoyl]oxy-propyl]-methyl-ammonium chloride Formula: C14H23ClN2O3 MolecularWeight: 302.79702

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CC=C(C=C1)C(=O)OCC(C[NH2+]C)O.[Cl-]

Isomeric SMILES

CCCNC1=CC=C(C=C1)C(=O)OCC(C[NH2+]C)O.[Cl-]

InChI

InChI=1S/C14H22N2O3.ClH/c1-3-8-16-12-6-4-11(5-7-12)14(18)19-10-13(17)9-15-2;/h4-7,13,15-17H,3,8-10H2,1-2H3;1H