3-nitro-4-(propan-2-ylamino)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(propan-2-ylamino)benzenecarbonitrile Openeye Name: 4-(isopropylamino)-3-nitro-benzonitrile CAS Name: 3-nitro-4-(propan-2-ylamino)benzonitrile IUPAC Name: 3-nitro-4-(propan-2-ylamino)benzonitrile Traditional Name: 4-(isopropylamino)-3-nitro-benzonitrile Formula: C10H11N3O2 MolecularWeight: 205.21324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O2/c1-7(2)12-9-4-3-8(6-11)5-10(9)13(14)15/h3-5,7,12H,1-2H3