2-[[3-methyl-4-[2-(3-nitrophenoxy)ethanoylamino]phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[3-methyl-4-[2-(3-nitrophenoxy)ethanoylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[3-methyl-4-[[2-(3-nitrophenoxy)acetyl]amino]benzoyl]amino]benzoic acid CAS Name: 2-[[[3-methyl-4-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[3-methyl-4-[[2-(3-nitrophenoxy)acetyl]amino]benzoyl]amino]benzoic acid Traditional Name: 2-[[3-methyl-4-[[2-(3-nitrophenoxy)acetyl]amino]benzoyl]amino]benzoic acid Formula: C23H19N3O7 MolecularWeight: 449.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)O)NC(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)O)NC(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O7/c1-14-11-15(22(28)25-20-8-3-2-7-18(20)23(29)30)9-10-19(14)24-21(27)13-33-17-6-4-5-16(12-17)26(31)32/h2-12H,13H2,1H3,(H,24,27)(H,25,28)(H,29,30)