sodium 3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylamino]benzoate

Systemtic Name: sodium 3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethanoylamino]benzoate Openeye Name: sodium 3-[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]amino]benzoate CAS Name: sodium 3-[[2-(3-methyl-4-propan-2-ylphenoxy)-1-oxoethyl]amino]benzoate IUPAC Name: sodium 3-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]benzoate Traditional Name: sodium 3-[[2-(4-isopropyl-3-methyl-phenoxy)acetyl]amino]benzoate Formula: C19H20NNaO4 MolecularWeight: 349.35617

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)[O-])C(C)C.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)[O-])C(C)C.[Na+]

InChI

InChI=1S/C19H21NO4.Na/c1-12(2)17-8-7-16(9-13(17)3)24-11-18(21)20-15-6-4-5-14(10-15)19(22)23;/h4-10,12H,11H2,1-3H3,(H,20,21)(H,22,23);/q;+1/p-1