5-[4-(1-hydroxyethyl)-3-methyl-5-nitro-phenoxy]-N-methyl-N-(phenylmethyl)pentanamide

Systemtic Name: 5-[4-(1-hydroxyethyl)-3-methyl-5-nitro-phenoxy]-N-methyl-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-5-[4-(1-hydroxyethyl)-3-methyl-5-nitro-phenoxy]-N-methyl-pentanamide CAS Name: 5-[4-(1-hydroxyethyl)-3-methyl-5-nitrophenoxy]-N-methyl-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-5-[4-(1-hydroxyethyl)-3-methyl-5-nitrophenoxy]-N-methylpentanamide Traditional Name: N-benzyl-5-[4-(1-hydroxyethyl)-3-methyl-5-nitro-phenoxy]-N-methyl-valeramide Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(C)O)[N+](=O)[O-])OCCCCC(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=CC(=C1C(C)O)[N+](=O)[O-])OCCCCC(=O)N(C)CC2=CC=CC=C2

InChI

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