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

Systemtic Name: sodium [4-(4-chloranylphenoxy)-4-oxidanylidene-butyl]carbamoyloxymethyl 4-methoxybenzoate Openeye Name: sodium [4-(4-chlorophenoxy)-4-oxo-butyl]carbamoyloxymethyl 4-methoxybenzoate CAS Name: sodium 4-methoxybenzoic acid [[[4-(4-chlorophenoxy)-4-oxobutyl]amino]-oxomethoxy]methyl ester IUPAC Name: sodium [4-(4-chlorophenoxy)-4-oxobutyl]carbamoyloxymethyl 4-methoxybenzoate Traditional Name: sodium 4-methoxybenzoic acid [4-(4-chlorophenoxy)-4-keto-butyl]carbamoyloxymethyl ester Formula: C20H20ClNNaO7+ MolecularWeight: 444.81807

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCOC(=O)NCCCC(=O)OC2=CC=C(C=C2)Cl.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OCOC(=O)NCCCC(=O)OC2=CC=C(C=C2)Cl.[Na+]

InChI

InChI=1S/C20H20ClNO7.Na/c1-26-16-8-4-14(5-9-16)19(24)27-13-28-20(25)22-12-2-3-18(23)29-17-10-6-15(21)7-11-17;/h4-11H,2-3,12-13H2,1H3,(H,22,25);/q;+1