3-nitro-4-(4-propylphenoxy)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(4-propylphenoxy)benzenecarbonitrile Openeye Name: 3-nitro-4-(4-propylphenoxy)benzonitrile CAS Name: 3-nitro-4-(4-propylphenoxy)benzonitrile IUPAC Name: 3-nitro-4-(4-propylphenoxy)benzonitrile Traditional Name: 3-nitro-4-(4-propylphenoxy)benzonitrile Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O3/c1-2-3-12-4-7-14(8-5-12)21-16-9-6-13(11-17)10-15(16)18(19)20/h4-10H,2-3H2,1H3