5-[butyl(hexyl)amino]-2-(3-methoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[butyl(hexyl)amino]-2-(3-methoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 5-[butyl(hexyl)amino]-2-isopropyl-2-(3-methoxyphenyl)pentanenitrile CAS Name: 5-[butyl(hexyl)amino]-2-(3-methoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-[butyl(hexyl)amino]-2-(3-methoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 5-[butyl(hexyl)amino]-2-isopropyl-2-(3-methoxyphenyl)valeronitrile Formula: C25H42N2O MolecularWeight: 386.61378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCC)CCCC(C#N)(C1=CC(=CC=C1)OC)C(C)C

Isomeric SMILES

CCCCCCN(CCCC)CCCC(C#N)(C1=CC(=CC=C1)OC)C(C)C

InChI

InChI=1S/C25H42N2O/c1-6-8-10-11-18-27(17-9-7-2)19-13-16-25(21-26,22(3)4)23-14-12-15-24(20-23)28-5/h12,14-15,20,22H,6-11,13,16-19H2,1-5H3