sodium (4-chlorophenyl) 4-[(2-methyl-1-propanoyloxy-propoxy)carbonylamino]butanoate

Systemtic Name: sodium (4-chlorophenyl) 4-[(2-methyl-1-propanoyloxy-propoxy)carbonylamino]butanoate Openeye Name: sodium (4-chlorophenyl) 4-[(2-methyl-1-propanoyloxy-propoxy)carbonylamino]butanoate CAS Name: sodium 4-[[[2-methyl-1-(1-oxopropoxy)propoxy]-oxomethyl]amino]butanoic acid (4-chlorophenyl) ester IUPAC Name: sodium (4-chlorophenyl) 4-[(2-methyl-1-propanoyloxypropoxy)carbonylamino]butanoate Traditional Name: sodium 4-[(2-methyl-1-propionyloxy-propoxy)carbonylamino]butyric acid (4-chlorophenyl) ester Formula: C18H24ClNNaO6+ MolecularWeight: 408.82903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24ClNO6.Na/c1-4-15(21)25-17(12(2)3)26-18(23)20-11-5-6-16(22)24-14-9-7-13(19)8-10-14;/h7-10,12,17H,4-6,11H2,1-3H3,(H,20,23);/q;+1