sodium [4-(4-chloranylphenoxy)-4-oxidanylidene-butyl]carbamoyloxymethyl pentanoate

Systemtic Name: sodium [4-(4-chloranylphenoxy)-4-oxidanylidene-butyl]carbamoyloxymethyl pentanoate Openeye Name: sodium [4-(4-chlorophenoxy)-4-oxo-butyl]carbamoyloxymethyl pentanoate CAS Name: sodium pentanoic acid [[[4-(4-chlorophenoxy)-4-oxobutyl]amino]-oxomethoxy]methyl ester IUPAC Name: sodium [4-(4-chlorophenoxy)-4-oxobutyl]carbamoyloxymethyl pentanoate Traditional Name: sodium valeric acid [4-(4-chlorophenoxy)-4-keto-butyl]carbamoyloxymethyl ester Formula: C17H22ClNNaO6+ MolecularWeight: 394.80245

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCOC(=O)NCCCC(=O)OC1=CC=C(C=C1)Cl.[Na+]

Isomeric SMILES

CCCCC(=O)OCOC(=O)NCCCC(=O)OC1=CC=C(C=C1)Cl.[Na+]

InChI

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