2-(3,4-dimethoxyphenyl)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-isopropyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2-hydroxyethyl)-1-piperazinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2-hydroxyethyl)piperazino]-2-isopropyl-valeronitrile Formula: C22H35N3O3 MolecularWeight: 389.5316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCO)(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCO)(C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H35N3O3/c1-18(2)22(17-23,19-6-7-20(27-3)21(16-19)28-4)8-5-9-24-10-12-25(13-11-24)14-15-26/h6-7,16,18,26H,5,8-15H2,1-4H3