3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]benzonitrile CAS Name: 3-[[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]benzonitrile Traditional Name: 3-[2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]benzonitrile Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H20N2O3/c1-24-16-8-9-19(25-2)17(12-16)18-7-4-10-22(18)20(23)15-6-3-5-14(11-15)13-21/h3,5-6,8-9,11-12,18H,4,7,10H2,1-2H3