3-chloranyl-4-[2-oxidanylidene-2-(4-propylphenyl)ethoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[2-oxidanylidene-2-(4-propylphenyl)ethoxy]benzenecarbonitrile Openeye Name: 3-chloro-4-[2-oxo-2-(4-propylphenyl)ethoxy]benzonitrile CAS Name: 3-chloro-4-[2-oxo-2-(4-propylphenyl)ethoxy]benzonitrile IUPAC Name: 3-chloro-4-[2-oxo-2-(4-propylphenyl)ethoxy]benzonitrile Traditional Name: 3-chloro-4-[2-keto-2-(4-propylphenyl)ethoxy]benzonitrile Formula: C18H16ClNO2 MolecularWeight: 313.77814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)COC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)COC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C18H16ClNO2/c1-2-3-13-4-7-15(8-5-13)17(21)12-22-18-9-6-14(11-20)10-16(18)19/h4-10H,2-3,12H2,1H3