5-nitro-2-[1-(4-propan-2-ylphenyl)ethylamino]pyridine-3-carbonitrile

Systemtic Name: 5-nitro-2-[1-(4-propan-2-ylphenyl)ethylamino]pyridine-3-carbonitrile Openeye Name: 2-[1-(4-isopropylphenyl)ethylamino]-5-nitro-pyridine-3-carbonitrile CAS Name: 5-nitro-2-[1-(4-propan-2-ylphenyl)ethylamino]-3-pyridinecarbonitrile IUPAC Name: 5-nitro-2-[1-(4-propan-2-ylphenyl)ethylamino]pyridine-3-carbonitrile Traditional Name: 5-nitro-2-(1-p-cumenylethylamino)nicotinonitrile Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)NC2=NC=C(C=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C)NC2=NC=C(C=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O2/c1-11(2)13-4-6-14(7-5-13)12(3)20-17-15(9-18)8-16(10-19-17)21(22)23/h4-8,10-12H,1-3H3,(H,19,20)