2-(3,4-dimethoxyphenyl)-5-(piperidin-4-ylamino)-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-(piperidin-4-ylamino)-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(4-piperidylamino)pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-(4-piperidinylamino)-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-(piperidin-4-ylamino)-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(4-piperidylamino)valeronitrile Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCNC1CCNCC1)(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)C(CCCNC1CCNCC1)(C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H33N3O2/c1-16(2)21(15-22,10-5-11-24-18-8-12-23-13-9-18)17-6-7-19(25-3)20(14-17)26-4/h6-7,14,16,18,23-24H,5,8-13H2,1-4H3