6-(4-chlorophenyl)-2-oxidanylidene-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-2-oxidanylidene-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile Openeye Name: 6-(4-chlorophenyl)-2-oxo-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-oxo-4-(4-phenyl-1-piperazinyl)-3-pyrancarbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-oxo-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile Traditional Name: 6-(4-chlorophenyl)-2-keto-4-(4-phenylpiperazino)pyran-3-carbonitrile Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)OC(=C3)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)OC(=C3)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C22H18ClN3O2/c23-17-8-6-16(7-9-17)21-14-20(19(15-24)22(27)28-21)26-12-10-25(11-13-26)18-4-2-1-3-5-18/h1-9,14H,10-13H2