2-nitro-5-(propan-2-ylamino)benzoic acid

Systemtic Name: 2-nitro-5-(propan-2-ylamino)benzoic acid Openeye Name: 5-(isopropylamino)-2-nitro-benzoic acid CAS Name: 2-nitro-5-(propan-2-ylamino)benzoic acid IUPAC Name: 2-nitro-5-(propan-2-ylamino)benzoic acid Traditional Name: 5-(isopropylamino)-2-nitro-benzoic acid Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O4/c1-6(2)11-7-3-4-9(12(15)16)8(5-7)10(13)14/h3-6,11H,1-2H3,(H,13,14)