sodium (4-chlorophenyl) 4-(1-propanoyloxypropoxycarbonylamino)butanoate

Systemtic Name: sodium (4-chlorophenyl) 4-(1-propanoyloxypropoxycarbonylamino)butanoate Openeye Name: sodium (4-chlorophenyl) 4-(1-propanoyloxypropoxycarbonylamino)butanoate CAS Name: sodium 4-[[oxo-[1-(1-oxopropoxy)propoxy]methyl]amino]butanoic acid (4-chlorophenyl) ester IUPAC Name: sodium (4-chlorophenyl) 4-(1-propanoyloxypropoxycarbonylamino)butanoate Traditional Name: sodium 4-(1-propionyloxypropoxycarbonylamino)butyric acid (4-chlorophenyl) ester Formula: C17H22ClNNaO6+ MolecularWeight: 394.80245

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC(=O)CC)OC(=O)NCCCC(=O)OC1=CC=C(C=C1)Cl.[Na+]

Isomeric SMILES

CCC(OC(=O)CC)OC(=O)NCCCC(=O)OC1=CC=C(C=C1)Cl.[Na+]

InChI

InChI=1S/C17H22ClNO6.Na/c1-3-14(20)24-16(4-2)25-17(22)19-11-5-6-15(21)23-13-9-7-12(18)8-10-13;/h7-10,16H,3-6,11H2,1-2H3,(H,19,22);/q;+1