6-oxidanylidene-5-(1-phenyl-4-pyrrolidin-1-yl-butyl)cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 6-oxidanylidene-5-(1-phenyl-4-pyrrolidin-1-yl-butyl)cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 6-oxo-5-(1-phenyl-4-pyrrolidin-1-yl-butyl)cyclohexa-1,3-diene-1-carbonitrile CAS Name: 6-oxo-5-[1-phenyl-4-(1-pyrrolidinyl)butyl]-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 6-oxo-5-(1-phenyl-4-pyrrolidin-1-ylbutyl)cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 6-keto-5-(1-phenyl-4-pyrrolidino-butyl)cyclohexa-1,3-diene-1-carbonitrile Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCC(C2C=CC=C(C2=O)C#N)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CCCC(C2C=CC=C(C2=O)C#N)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O/c22-16-18-10-6-11-20(21(18)24)19(17-8-2-1-3-9-17)12-7-15-23-13-4-5-14-23/h1-3,6,8-11,19-20H,4-5,7,12-15H2