4-[[5-[butyl(propanoyl)amino]-2-carboxy-phenyl]carbamoyl]benzoate

Systemtic Name: 4-[[5-[butyl(propanoyl)amino]-2-carboxy-phenyl]carbamoyl]benzoate Openeye Name: 4-[[5-[butyl(propanoyl)amino]-2-carboxy-phenyl]carbamoyl]benzoate CAS Name: 4-[[5-[butyl(1-oxopropyl)amino]-2-carboxyanilino]-oxomethyl]benzoate IUPAC Name: 4-[[5-[butyl(propanoyl)amino]-2-carboxyphenyl]carbamoyl]benzoate Traditional Name: 4-[[5-[butyl(propionyl)amino]-2-carboxy-phenyl]carbamoyl]benzoate Formula: C22H23N2O6- MolecularWeight: 411.42782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC(=C(C=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)C(=O)[O-])C(=O)CC

Isomeric SMILES

CCCCN(C1=CC(=C(C=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)C(=O)[O-])C(=O)CC

InChI

InChI=1S/C22H24N2O6/c1-3-5-12-24(19(25)4-2)16-10-11-17(22(29)30)18(13-16)23-20(26)14-6-8-15(9-7-14)21(27)28/h6-11,13H,3-5,12H2,1-2H3,(H,23,26)(H,27,28)(H,29,30)/p-1