sodium 1-[[4-(4-chloranylphenoxy)-4-oxidanylidene-butyl]carbamoyloxy]ethyl benzoate

Systemtic Name: sodium 1-[[4-(4-chloranylphenoxy)-4-oxidanylidene-butyl]carbamoyloxy]ethyl benzoate Openeye Name: sodium 1-[[4-(4-chlorophenoxy)-4-oxo-butyl]carbamoyloxy]ethyl benzoate CAS Name: sodium benzoic acid 1-[[[4-(4-chlorophenoxy)-4-oxobutyl]amino]-oxomethoxy]ethyl ester IUPAC Name: sodium 1-[[4-(4-chlorophenoxy)-4-oxobutyl]carbamoyloxy]ethyl benzoate Traditional Name: sodium benzoic acid 1-[[4-(4-chlorophenoxy)-4-keto-butyl]carbamoyloxy]ethyl ester Formula: C20H20ClNNaO6+ MolecularWeight: 428.81867

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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