3-[(E)-3-oxidanylidene-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-oxidanylidene-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-oxo-3-[2-(1-piperidylmethyl)pyrrolidin-1-yl]prop-1-enyl]benzonitrile CAS Name: 3-[(E)-3-oxo-3-[2-(1-piperidinylmethyl)-1-pyrrolidinyl]prop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-3-oxo-3-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]prop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-keto-3-[2-(piperidinomethyl)pyrrolidino]prop-1-enyl]benzonitrile Formula: C20H25N3O MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2CCCN2C(=O)C=CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(CC1)CC2CCCN2C(=O)/C=C/C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H25N3O/c21-15-18-7-4-6-17(14-18)9-10-20(24)23-13-5-8-19(23)16-22-11-2-1-3-12-22/h4,6-7,9-10,14,19H,1-3,5,8,11-13,16H2/b10-9+