4-azanyl-2-ethyl-3-nitro-benzoic acid

Systemtic Name: 4-azanyl-2-ethyl-3-nitro-benzoic acid Openeye Name: 4-amino-2-ethyl-3-nitro-benzoic acid CAS Name: 4-amino-2-ethyl-3-nitrobenzoic acid IUPAC Name: 4-amino-2-ethyl-3-nitrobenzoic acid Traditional Name: 4-amino-2-ethyl-3-nitro-benzoic acid Formula: C9H10N2O4 MolecularWeight: 210.1867

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1[N+](=O)[O-])N)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1[N+](=O)[O-])N)C(=O)O

InChI

InChI=1S/C9H10N2O4/c1-2-5-6(9(12)13)3-4-7(10)8(5)11(14)15/h3-4H,2,10H2,1H3,(H,12,13)