4-(dibutylamino)-3-nitro-benzoic acid

Systemtic Name: 4-(dibutylamino)-3-nitro-benzoic acid Openeye Name: 4-(dibutylamino)-3-nitro-benzoic acid CAS Name: 4-(dibutylamino)-3-nitrobenzoic acid IUPAC Name: 4-(dibutylamino)-3-nitrobenzoic acid Traditional Name: 4-(dibutylamino)-3-nitro-benzoic acid Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O4/c1-3-5-9-16(10-6-4-2)13-8-7-12(15(18)19)11-14(13)17(20)21/h7-8,11H,3-6,9-10H2,1-2H3,(H,18,19)