2-[(E)-3-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-3-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 2-[(E)-3-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 2-[(E)-3-[(2S)-2-(4-methoxyphenyl)-1-pyrrolidinyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 2-[(E)-3-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 2-[(E)-3-keto-3-[(2S)-2-(4-methoxyphenyl)pyrrolidino]prop-1-enyl]benzonitrile Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)C=CC3=CC=CC=C3C#N

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CCCN2C(=O)/C=C/C3=CC=CC=C3C#N

InChI

InChI=1S/C21H20N2O2/c1-25-19-11-8-17(9-12-19)20-7-4-14-23(20)21(24)13-10-16-5-2-3-6-18(16)15-22/h2-3,5-6,8-13,20H,4,7,14H2,1H3/b13-10+/t20-/m0/s1