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

Systemtic Name: 3-nitro-4-(3-propan-2-ylphenoxy)benzenecarbonitrile Openeye Name: 4-(3-isopropylphenoxy)-3-nitro-benzonitrile CAS Name: 3-nitro-4-(3-propan-2-ylphenoxy)benzonitrile IUPAC Name: 3-nitro-4-(3-propan-2-ylphenoxy)benzonitrile Traditional Name: 4-(3-isopropylphenoxy)-3-nitro-benzonitrile Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O3/c1-11(2)13-4-3-5-14(9-13)21-16-7-6-12(10-17)8-15(16)18(19)20/h3-9,11H,1-2H3