2-(dipropylamino)-5-nitro-benzoic acid

Systemtic Name: 2-(dipropylamino)-5-nitro-benzoic acid Openeye Name: 2-(dipropylamino)-5-nitro-benzoic acid CAS Name: 2-(dipropylamino)-5-nitrobenzoic acid IUPAC Name: 2-(dipropylamino)-5-nitrobenzoic acid Traditional Name: 2-(dipropylamino)-5-nitro-benzoic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCN(CCC)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H18N2O4/c1-3-7-14(8-4-2)12-6-5-10(15(18)19)9-11(12)13(16)17/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)