3,5-bis(chloranyl)-4-(4-pentoxyphenyl)benzenecarbonitrile

Systemtic Name: 3,5-bis(chloranyl)-4-(4-pentoxyphenyl)benzenecarbonitrile Openeye Name: 3,5-dichloro-4-(4-pentoxyphenyl)benzonitrile CAS Name: 3,5-dichloro-4-(4-pentoxyphenyl)benzonitrile IUPAC Name: 3,5-dichloro-4-(4-pentoxyphenyl)benzonitrile Traditional Name: 4-(4-amoxyphenyl)-3,5-dichloro-benzonitrile Formula: C18H17Cl2NO MolecularWeight: 334.23968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=C(C=C(C=C2Cl)C#N)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=C(C=C(C=C2Cl)C#N)Cl

InChI

InChI=1S/C18H17Cl2NO/c1-2-3-4-9-22-15-7-5-14(6-8-15)18-16(19)10-13(12-21)11-17(18)20/h5-8,10-11H,2-4,9H2,1H3