5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-(1,3-dioxoisoindolin-2-yl)-2-isopropyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-(1,3-dioxo-2-isoindolyl)-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-(1,3-dioxoisoindol-2-yl)-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-phthalimido-valeronitrile Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1C(=O)C2=CC=CC=C2C1=O)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(CCCN1C(=O)C2=CC=CC=C2C1=O)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H26N2O4/c1-16(2)24(15-25,17-10-11-20(29-3)21(14-17)30-4)12-7-13-26-22(27)18-8-5-6-9-19(18)23(26)28/h5-6,8-11,14,16H,7,12-13H2,1-4H3