4-[[3-(2-methylpropanoylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[3-(2-methylpropanoylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[3-(2-methylpropanoylamino)benzoyl]amino]benzoic acid CAS Name: 4-[[[3-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[3-(2-methylpropanoylamino)benzoyl]amino]benzoic acid Traditional Name: 4-[[3-(isobutyrylamino)benzoyl]amino]benzoic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H18N2O4/c1-11(2)16(21)20-15-5-3-4-13(10-15)17(22)19-14-8-6-12(7-9-14)18(23)24/h3-11H,1-2H3,(H,19,22)(H,20,21)(H,23,24)