2-(3-methoxyphenyl)-2-[4-(methylamino)-6-(3-nitrophenyl)hexyl]tetradecanenitrile

Systemtic Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-(3-nitrophenyl)hexyl]tetradecanenitrile Openeye Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-(3-nitrophenyl)hexyl]tetradecanenitrile CAS Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-(3-nitrophenyl)hexyl]tetradecanenitrile IUPAC Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-(3-nitrophenyl)hexyl]tetradecanenitrile Traditional Name: 2-(3-methoxyphenyl)-2-[4-(methylamino)-6-(3-nitrophenyl)hexyl]myristonitrile Formula: C34H51N3O3 MolecularWeight: 549.78704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H51N3O3/c1-4-5-6-7-8-9-10-11-12-13-24-34(28-35,30-18-15-21-33(27-30)40-3)25-16-19-31(36-2)23-22-29-17-14-20-32(26-29)37(38)39/h14-15,17-18,20-21,26-27,31,36H,4-13,16,19,22-25H2,1-3H3