6-oxidanylidene-5-(1-phenyl-3-piperazin-1-yl-propyl)cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 6-oxidanylidene-5-(1-phenyl-3-piperazin-1-yl-propyl)cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 6-oxo-5-(1-phenyl-3-piperazin-1-yl-propyl)cyclohexa-1,3-diene-1-carbonitrile CAS Name: 6-oxo-5-[1-phenyl-3-(1-piperazinyl)propyl]-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 6-oxo-5-(1-phenyl-3-piperazin-1-ylpropyl)cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 6-keto-5-(1-phenyl-3-piperazino-propyl)cyclohexa-1,3-diene-1-carbonitrile Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCC(C2C=CC=C(C2=O)C#N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1)CCC(C2C=CC=C(C2=O)C#N)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O/c21-15-17-7-4-8-19(20(17)24)18(16-5-2-1-3-6-16)9-12-23-13-10-22-11-14-23/h1-8,18-19,22H,9-14H2