sodium 4-[(4-butoxyphenyl)carbonylamino]benzoate

Systemtic Name: sodium 4-[(4-butoxyphenyl)carbonylamino]benzoate Openeye Name: sodium 4-[(4-butoxybenzoyl)amino]benzoate CAS Name: sodium 4-[[(4-butoxyphenyl)-oxomethyl]amino]benzoate IUPAC Name: sodium 4-[(4-butoxybenzoyl)amino]benzoate Traditional Name: sodium 4-[(4-butoxybenzoyl)amino]benzoate Formula: C18H18NNaO4 MolecularWeight: 335.32959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)[O-].[Na+]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C18H19NO4.Na/c1-2-3-12-23-16-10-6-13(7-11-16)17(20)19-15-8-4-14(5-9-15)18(21)22;/h4-11H,2-3,12H2,1H3,(H,19,20)(H,21,22);/q;+1/p-1