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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1N)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1N)[N+](=O)[O-])C(=O)O

InChI

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