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

Systemtic Name: 6-azanyl-2-(3,4-dimethoxy-2,5-dipentoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-ethyl-heptanenitrile Openeye Name: 6-amino-2-(3,4-dimethoxy-2,5-dipentoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-ethyl-heptanenitrile CAS Name: 6-amino-2-(3,4-dimethoxy-2,5-dipentoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-ethylheptanenitrile IUPAC Name: 6-amino-2-(3,4-dimethoxy-2,5-dipentoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-ethylheptanenitrile Traditional Name: 6-amino-2-(2,5-diamoxy-3,4-dimethoxy-phenyl)-7-(3,4-dimethoxyphenyl)-2-ethyl-enanthonitrile Formula: C35H54N2O6 MolecularWeight: 598.81306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H54N2O6/c1-8-11-13-20-42-31-24-28(32(43-21-14-12-9-2)34(41-7)33(31)40-6)35(10-3,25-36)19-15-16-27(37)22-26-17-18-29(38-4)30(23-26)39-5/h17-18,23-24,27H,8-16,19-22,37H2,1-7H3