4-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]benzenecarbonitrile

Systemtic Name: 4-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]benzenecarbonitrile Openeye Name: 4-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]benzonitrile CAS Name: 4-[3-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]benzonitrile IUPAC Name: 4-[3-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]benzonitrile Traditional Name: 4-[3-[2-(2,5-dimethoxyphenyl)pyrrolidino]-3-keto-propyl]benzonitrile Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H24N2O3/c1-26-18-10-11-21(27-2)19(14-18)20-4-3-13-24(20)22(25)12-9-16-5-7-17(15-23)8-6-16/h5-8,10-11,14,20H,3-4,9,12-13H2,1-2H3