3-chloranyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 3-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzonitrile CAS Name: 3-chloro-4-[4-(2-methoxyphenyl)-1-piperazinyl]benzonitrile IUPAC Name: 3-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]benzonitrile Traditional Name: 3-chloro-4-[4-(2-methoxyphenyl)piperazino]benzonitrile Formula: C18H18ClN3O MolecularWeight: 327.80802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H18ClN3O/c1-23-18-5-3-2-4-17(18)22-10-8-21(9-11-22)16-7-6-14(13-20)12-15(16)19/h2-7,12H,8-11H2,1H3