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

Systemtic Name: 3-[4-(2-methylpropanoylamino)phenyl]carbonyloxy-4-nitro-benzoic acid Openeye Name: 3-[4-(2-methylpropanoylamino)benzoyl]oxy-4-nitro-benzoic acid CAS Name: 3-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethoxy]-4-nitrobenzoic acid IUPAC Name: 3-[4-(2-methylpropanoylamino)benzoyl]oxy-4-nitrobenzoic acid Traditional Name: 3-[4-(isobutyrylamino)benzoyl]oxy-4-nitro-benzoic acid Formula: C18H16N2O7 MolecularWeight: 372.32884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O7/c1-10(2)16(21)19-13-6-3-11(4-7-13)18(24)27-15-9-12(17(22)23)5-8-14(15)20(25)26/h3-10H,1-2H3,(H,19,21)(H,22,23)