ethanoic acid; 2-[2-(4-fluorophenyl)ethylamino]-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile

Systemtic Name: ethanoic acid; 2-[2-(4-fluorophenyl)ethylamino]-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile Openeye Name: acetic acid; 2-[2-(4-fluorophenyl)ethylamino]-4,6-dimethyl-5-nitro-pyridine-3-carbonitrile CAS Name: acetic acid; 2-[2-(4-fluorophenyl)ethylamino]-4,6-dimethyl-5-nitro-3-pyridinecarbonitrile IUPAC Name: acetic acid; 2-[2-(4-fluorophenyl)ethylamino]-4,6-dimethyl-5-nitropyridine-3-carbonitrile Traditional Name: acetic acid; 2-[2-(4-fluorophenyl)ethylamino]-4,6-dimethyl-5-nitro-nicotinonitrile Formula: C18H19FN4O4 MolecularWeight: 374.366263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1[N+](=O)[O-])C)NCCC2=CC=C(C=C2)F)C#N.CC(=O)O

Isomeric SMILES

CC1=C(C(=NC(=C1[N+](=O)[O-])C)NCCC2=CC=C(C=C2)F)C#N.CC(=O)O

InChI

InChI=1S/C16H15FN4O2.C2H4O2/c1-10-14(9-18)16(20-11(2)15(10)21(22)23)19-8-7-12-3-5-13(17)6-4-12;1-2(3)4/h3-6H,7-8H2,1-2H3,(H,19,20);1H3,(H,3,4)