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

Systemtic Name: 2-(4-nitrophenyl)-5-(propan-2-ylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(isopropylamino)-2-(4-nitrophenyl)oxazole-4-carbonitrile CAS Name: 2-(4-nitrophenyl)-5-(propan-2-ylamino)-4-oxazolecarbonitrile IUPAC Name: 2-(4-nitrophenyl)-5-(propan-2-ylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(isopropylamino)-2-(4-nitrophenyl)oxazole-4-carbonitrile Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(N=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)NC1=C(N=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H12N4O3/c1-8(2)15-13-11(7-14)16-12(20-13)9-3-5-10(6-4-9)17(18)19/h3-6,8,15H,1-2H3