2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[methyl-[(5-methylisoxazol-3-yl)methyl]amino]-5-nitro-benzonitrile CAS Name: 2-[methyl-[(5-methyl-3-isoxazolyl)methyl]amino]-5-nitrobenzonitrile IUPAC Name: 2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]-5-nitrobenzonitrile Traditional Name: 2-[methyl-[(5-methylisoxazol-3-yl)methyl]amino]-5-nitro-benzonitrile Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC(=NO1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H12N4O3/c1-9-5-11(15-20-9)8-16(2)13-4-3-12(17(18)19)6-10(13)7-14/h3-6H,8H2,1-2H3