4-[(4-ethylphenyl)amino]-3-nitro-benzoate

Systemtic Name: 4-[(4-ethylphenyl)amino]-3-nitro-benzoate Openeye Name: 4-(4-ethylanilino)-3-nitro-benzoate CAS Name: 4-(4-ethylanilino)-3-nitrobenzoate IUPAC Name: 4-(4-ethylanilino)-3-nitrobenzoate Traditional Name: 4-(4-ethylanilino)-3-nitro-benzoate Formula: C15H13N2O4- MolecularWeight: 285.27472

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c1-2-10-3-6-12(7-4-10)16-13-8-5-11(15(18)19)9-14(13)17(20)21/h3-9,16H,2H2,1H3,(H,18,19)/p-1