6-[3-(1-hydroxyethyl)-5-methyl-2-nitro-phenoxy]-N-methyl-N-phenyl-hexanamide

Systemtic Name: 6-[3-(1-hydroxyethyl)-5-methyl-2-nitro-phenoxy]-N-methyl-N-phenyl-hexanamide Openeye Name: 6-[3-(1-hydroxyethyl)-5-methyl-2-nitro-phenoxy]-N-methyl-N-phenyl-hexanamide CAS Name: 6-[3-(1-hydroxyethyl)-5-methyl-2-nitrophenoxy]-N-methyl-N-phenylhexanamide IUPAC Name: 6-[3-(1-hydroxyethyl)-5-methyl-2-nitrophenoxy]-N-methyl-N-phenylhexanamide Traditional Name: 6-[3-(1-hydroxyethyl)-5-methyl-2-nitro-phenoxy]-N-methyl-N-phenyl-hexanamide Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCCCC(=O)N(C)C2=CC=CC=C2)[N+](=O)[O-])C(C)O

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCCCC(=O)N(C)C2=CC=CC=C2)[N+](=O)[O-])C(C)O

InChI

InChI=1S/C22H28N2O5/c1-16-14-19(17(2)25)22(24(27)28)20(15-16)29-13-9-5-8-12-21(26)23(3)18-10-6-4-7-11-18/h4,6-7,10-11,14-15,17,25H,5,8-9,12-13H2,1-3H3