2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-5-nitro-benzonitrile CAS Name: 2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazino]-5-nitro-benzonitrile Formula: C15H16N6O3 MolecularWeight: 328.32594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)CN2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=NOC(=N1)CN2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H16N6O3/c1-11-17-15(24-18-11)10-19-4-6-20(7-5-19)14-3-2-13(21(22)23)8-12(14)9-16/h2-3,8H,4-7,10H2,1H3