4-(4-chloranyl-3-methyl-phenoxy)-5-piperidin-1-yl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-5-piperidin-1-yl-benzene-1,2-dicarbonitrile Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-5-(1-piperidyl)phthalonitrile CAS Name: 4-(4-chloro-3-methylphenoxy)-5-(1-piperidinyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-(4-chloro-3-methylphenoxy)-5-piperidin-1-ylbenzene-1,2-dicarbonitrile Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-5-piperidino-phthalonitrile Formula: C20H18ClN3O MolecularWeight: 351.82942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=C(C(=C2)C#N)C#N)N3CCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=C(C(=C2)C#N)C#N)N3CCCCC3)Cl

InChI

InChI=1S/C20H18ClN3O/c1-14-9-17(5-6-18(14)21)25-20-11-16(13-23)15(12-22)10-19(20)24-7-3-2-4-8-24/h5-6,9-11H,2-4,7-8H2,1H3