2-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenyl)ethanenitrile

Systemtic Name: 2-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenyl)ethanenitrile Openeye Name: 2-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenyl)acetonitrile CAS Name: 2-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenyl)acetonitrile IUPAC Name: 2-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenyl)acetonitrile Traditional Name: 2-[3-(4-chlorophenyl)-2-pyrazolin-1-yl]-2-(2-methoxyphenyl)acetonitrile Formula: C18H16ClN3O MolecularWeight: 325.79214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C#N)N2CCC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1C(C#N)N2CCC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O/c1-23-18-5-3-2-4-15(18)17(12-20)22-11-10-16(21-22)13-6-8-14(19)9-7-13/h2-9,17H,10-11H2,1H3