5-(2-methylpropylamino)-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(2-methylpropylamino)-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(isobutylamino)-2-(4-nitrophenyl)oxazole-4-carbonitrile CAS Name: 5-(2-methylpropylamino)-2-(4-nitrophenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(2-methylpropylamino)-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(isobutylamino)-2-(4-nitrophenyl)oxazole-4-carbonitrile Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C(N=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)CNC1=C(N=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H14N4O3/c1-9(2)8-16-14-12(7-15)17-13(21-14)10-3-5-11(6-4-10)18(19)20/h3-6,9,16H,8H2,1-2H3