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

Systemtic Name: sodium (4-chlorophenyl) 4-(1-butanoyloxybutoxycarbonylamino)butanoate Openeye Name: sodium (4-chlorophenyl) 4-(1-butanoyloxybutoxycarbonylamino)butanoate CAS Name: sodium 4-[[oxo-[1-(1-oxobutoxy)butoxy]methyl]amino]butanoic acid (4-chlorophenyl) ester IUPAC Name: sodium (4-chlorophenyl) 4-(1-butanoyloxybutoxycarbonylamino)butanoate Traditional Name: sodium 4-(1-butyryloxybutoxycarbonylamino)butyric acid (4-chlorophenyl) ester Formula: C19H26ClNNaO6+ MolecularWeight: 422.85561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26ClNO6.Na/c1-3-6-16(22)26-18(7-4-2)27-19(24)21-13-5-8-17(23)25-15-11-9-14(20)10-12-15;/h9-12,18H,3-8,13H2,1-2H3,(H,21,24);/q;+1