5-nitro-2-(pentan-3-ylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(pentan-3-ylamino)benzenecarbonitrile Openeye Name: 2-(1-ethylpropylamino)-5-nitro-benzonitrile CAS Name: 5-nitro-2-(pentan-3-ylamino)benzonitrile IUPAC Name: 5-nitro-2-(pentan-3-ylamino)benzonitrile Traditional Name: 2-(1-ethylpropylamino)-5-nitro-benzonitrile Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CCC(CC)NC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H15N3O2/c1-3-10(4-2)14-12-6-5-11(15(16)17)7-9(12)8-13/h5-7,10,14H,3-4H2,1-2H3