3-[(E)-3-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 3-[(E)-3-[4-methoxy-3-(1-pyrrolidinylmethyl)phenyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-3-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-keto-3-[4-methoxy-3-(pyrrolidinomethyl)phenyl]prop-1-enyl]benzonitrile Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC=CC(=C2)C#N)CN3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=CC(=C2)C#N)CN3CCCC3

InChI

InChI=1S/C22H22N2O2/c1-26-22-10-8-19(14-20(22)16-24-11-2-3-12-24)21(25)9-7-17-5-4-6-18(13-17)15-23/h4-10,13-14H,2-3,11-12,16H2,1H3/b9-7+