6-azanyl-2-(3,4-dimethoxy-2,5-dipentoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-pentan-3-yl-heptanenitrile

Systemtic Name: 6-azanyl-2-(3,4-dimethoxy-2,5-dipentoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-pentan-3-yl-heptanenitrile Openeye Name: 6-amino-2-(3,4-dimethoxy-2,5-dipentoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-(1-ethylpropyl)heptanenitrile CAS Name: 6-amino-2-(3,4-dimethoxy-2,5-dipentoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-pentan-3-ylheptanenitrile IUPAC Name: 6-amino-2-(3,4-dimethoxy-2,5-dipentoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-pentan-3-ylheptanenitrile Traditional Name: 6-amino-2-(2,5-diamoxy-3,4-dimethoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-(1-ethylpropyl)enanthonitrile Formula: C38H60N2O6 MolecularWeight: 640.8928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=C(C(=C1)C(CCCC(CC2=CC(=C(C=C2)OC)OC)N)(C#N)C(CC)CC)OCCCCC)OC)OC

Isomeric SMILES

CCCCCOC1=C(C(=C(C(=C1)C(CCCC(CC2=CC(=C(C=C2)OC)OC)N)(C#N)C(CC)CC)OCCCCC)OC)OC

InChI

InChI=1S/C38H60N2O6/c1-9-13-15-22-45-34-26-31(35(46-23-16-14-10-2)37(44-8)36(34)43-7)38(27-39,29(11-3)12-4)21-17-18-30(40)24-28-19-20-32(41-5)33(25-28)42-6/h19-20,25-26,29-30H,9-18,21-24,40H2,1-8H3