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

Systemtic Name: 3-[2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-[2-(2,4-dimethoxyphenyl)pyrrolidino]-2-keto-ethoxy]benzonitrile Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C(=O)COC3=CC=CC(=C3)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2C(=O)COC3=CC=CC(=C3)C#N)OC

InChI

InChI=1S/C21H22N2O4/c1-25-16-8-9-18(20(12-16)26-2)19-7-4-10-23(19)21(24)14-27-17-6-3-5-15(11-17)13-22/h3,5-6,8-9,11-12,19H,4,7,10,14H2,1-2H3