2-[6-(4-methoxy-3-nitro-phenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile

Systemtic Name: 2-[6-(4-methoxy-3-nitro-phenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile Openeye Name: 2-[6-(4-methoxy-3-nitro-phenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile CAS Name: 2-[6-(4-methoxy-3-nitrophenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile IUPAC Name: 2-[6-(4-methoxy-3-nitrophenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile Traditional Name: 2-[6-(4-methoxy-3-nitro-phenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)myristonitrile Formula: C35H53N3O4 MolecularWeight: 579.81302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCC(CCC1=CC(=C(C=C1)OC)[N+](=O)[O-])NC)(C#N)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCCCCCCCCCCC(CCCC(CCC1=CC(=C(C=C1)OC)[N+](=O)[O-])NC)(C#N)C2=CC(=CC=C2)OC

InChI

InChI=1S/C35H53N3O4/c1-5-6-7-8-9-10-11-12-13-14-24-35(28-36,30-17-15-19-32(27-30)41-3)25-16-18-31(37-2)22-20-29-21-23-34(42-4)33(26-29)38(39)40/h15,17,19,21,23,26-27,31,37H,5-14,16,18,20,22,24-25H2,1-4H3