4-(4-chloranyl-3-ethyl-phenoxy)-3-nitro-benzenecarbonitrile

Systemtic Name: 4-(4-chloranyl-3-ethyl-phenoxy)-3-nitro-benzenecarbonitrile Openeye Name: 4-(4-chloro-3-ethyl-phenoxy)-3-nitro-benzonitrile CAS Name: 4-(4-chloro-3-ethylphenoxy)-3-nitrobenzonitrile IUPAC Name: 4-(4-chloro-3-ethylphenoxy)-3-nitrobenzonitrile Traditional Name: 4-(4-chloro-3-ethyl-phenoxy)-3-nitro-benzonitrile Formula: C15H11ClN2O3 MolecularWeight: 302.71244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C#N)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN2O3/c1-2-11-8-12(4-5-13(11)16)21-15-6-3-10(9-17)7-14(15)18(19)20/h3-8H,2H2,1H3