3-[2-(4H-1,3-benzodioxin-6-yl)ethyl-methyl-amino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile

Systemtic Name: 3-[2-(4H-1,3-benzodioxin-6-yl)ethyl-methyl-amino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Openeye Name: 3-[2-(4H-1,3-benzodioxin-6-yl)ethyl-methyl-amino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)pentanenitrile CAS Name: 3-[2-(4H-1,3-benzodioxin-6-yl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile IUPAC Name: 3-[2-(4H-1,3-benzodioxin-6-yl)ethyl-methylamino]-2-propan-2-yl-2-(3,4,5-trimethoxyphenyl)pentanenitrile Traditional Name: 3-[2-(4H-1,3-benzodioxin-6-yl)ethyl-methyl-amino]-2-isopropyl-2-(3,4,5-trimethoxyphenyl)valeronitrile Formula: C28H38N2O5 MolecularWeight: 482.61172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C#N)(C1=CC(=C(C(=C1)OC)OC)OC)C(C)C)N(C)CCC2=CC3=C(C=C2)OCOC3

Isomeric SMILES

CCC(C(C#N)(C1=CC(=C(C(=C1)OC)OC)OC)C(C)C)N(C)CCC2=CC3=C(C=C2)OCOC3

InChI

InChI=1S/C28H38N2O5/c1-8-26(30(4)12-11-20-9-10-23-21(13-20)16-34-18-35-23)28(17-29,19(2)3)22-14-24(31-5)27(33-7)25(15-22)32-6/h9-10,13-15,19,26H,8,11-12,16,18H2,1-7H3