2-(3,4-dimethoxyphenyl)-2-(3-methylidene-5-phenyl-pyrazolidin-1-yl)ethanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-(3-methylidene-5-phenyl-pyrazolidin-1-yl)ethanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-(3-methylene-5-phenyl-pyrazolidin-1-yl)acetonitrile CAS Name: 2-(3,4-dimethoxyphenyl)-2-(3-methylene-5-phenyl-1-pyrazolidinyl)acetonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-(3-methylidene-5-phenylpyrazolidin-1-yl)acetonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-(3-methylene-5-phenyl-pyrazolidin-1-yl)acetonitrile Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)N2C(CC(=C)N2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)N2C(CC(=C)N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H21N3O2/c1-14-11-17(15-7-5-4-6-8-15)23(22-14)18(13-21)16-9-10-19(24-2)20(12-16)25-3/h4-10,12,17-18,22H,1,11H2,2-3H3