2-(3-methoxyphenyl)-2-[4-(methylamino)-6-phenyl-hexyl]undecanenitrile

Systemtic Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-phenyl-hexyl]undecanenitrile Openeye Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-phenyl-hexyl]undecanenitrile CAS Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-phenylhexyl]undecanenitrile IUPAC Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-phenylhexyl]undecanenitrile Traditional Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-phenyl-hexyl]undecanenitrile Formula: C31H46N2O MolecularWeight: 462.70974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCC(CCC1=CC=CC=C1)NC)(C#N)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCCCCCCCC(CCCC(CCC1=CC=CC=C1)NC)(C#N)C2=CC(=CC=C2)OC

InChI

InChI=1S/C31H46N2O/c1-4-5-6-7-8-9-13-23-31(26-32,28-18-14-20-30(25-28)34-3)24-15-19-29(33-2)22-21-27-16-11-10-12-17-27/h10-12,14,16-18,20,25,29,33H,4-9,13,15,19,21-24H2,1-3H3