sodium (4-chlorophenyl) 4-[[acetyloxy(phenyl)methoxy]carbonylamino]butanoate

Systemtic Name: sodium (4-chlorophenyl) 4-[[acetyloxy(phenyl)methoxy]carbonylamino]butanoate Openeye Name: sodium (4-chlorophenyl) 4-[[acetoxy(phenyl)methoxy]carbonylamino]butanoate CAS Name: sodium 4-[[[acetyloxy(phenyl)methoxy]-oxomethyl]amino]butanoic acid (4-chlorophenyl) ester IUPAC Name: sodium (4-chlorophenyl) 4-[[acetyloxy(phenyl)methoxy]carbonylamino]butanoate Traditional Name: sodium 4-[[acetoxy(phenyl)methoxy]carbonylamino]butyric acid (4-chlorophenyl) ester Formula: C20H20ClNNaO6+ MolecularWeight: 428.81867

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)OC(=O)NCCCC(=O)OC2=CC=C(C=C2)Cl.[Na+]

Isomeric SMILES

CC(=O)OC(C1=CC=CC=C1)OC(=O)NCCCC(=O)OC2=CC=C(C=C2)Cl.[Na+]

InChI

InChI=1S/C20H20ClNO6.Na/c1-14(23)26-19(15-6-3-2-4-7-15)28-20(25)22-13-5-8-18(24)27-17-11-9-16(21)10-12-17;/h2-4,6-7,9-12,19H,5,8,13H2,1H3,(H,22,25);/q;+1