5-(octylamino)-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile

Systemtic Name: 5-(octylamino)-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Openeye Name: 2-isopropyl-5-(octylamino)-2-(3,4,5-trimethoxyphenyl)pentanenitrile CAS Name: 5-(octylamino)-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile IUPAC Name: 5-(octylamino)-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Traditional Name: 2-isopropyl-5-(octylamino)-2-(3,4,5-trimethoxyphenyl)valeronitrile Formula: C25H42N2O3 MolecularWeight: 418.61258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCCCC(C#N)(C1=CC(=C(C(=C1)OC)OC)OC)C(C)C

Isomeric SMILES

CCCCCCCCNCCCC(C#N)(C1=CC(=C(C(=C1)OC)OC)OC)C(C)C

InChI

InChI=1S/C25H42N2O3/c1-7-8-9-10-11-12-15-27-16-13-14-25(19-26,20(2)3)21-17-22(28-4)24(30-6)23(18-21)29-5/h17-18,20,27H,7-16H2,1-6H3