6-ethanoyl-3-(ethylamino)-4-nitro-2-propyl-phenolate

Systemtic Name: 6-ethanoyl-3-(ethylamino)-4-nitro-2-propyl-phenolate Openeye Name: 6-acetyl-3-(ethylamino)-4-nitro-2-propyl-phenolate CAS Name: 6-acetyl-3-(ethylamino)-4-nitro-2-propylphenolate IUPAC Name: 6-acetyl-3-(ethylamino)-4-nitro-2-propylphenolate Traditional Name: 6-acetyl-3-(ethylamino)-4-nitro-2-propyl-phenolate Formula: C13H17N2O4- MolecularWeight: 265.28508

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1NCC)[N+](=O)[O-])C(=O)C)[O-]

Isomeric SMILES

CCCC1=C(C(=CC(=C1NCC)[N+](=O)[O-])C(=O)C)[O-]

InChI

InChI=1S/C13H18N2O4/c1-4-6-9-12(14-5-2)11(15(18)19)7-10(8(3)16)13(9)17/h7,14,17H,4-6H2,1-3H3/p-1