6-[4-(1-hydroxyethyl)-2-methyl-5-nitro-phenoxy]-N,N-bis(phenylmethyl)hexanamide

Systemtic Name: 6-[4-(1-hydroxyethyl)-2-methyl-5-nitro-phenoxy]-N,N-bis(phenylmethyl)hexanamide Openeye Name: N,N-dibenzyl-6-[4-(1-hydroxyethyl)-2-methyl-5-nitro-phenoxy]hexanamide CAS Name: 6-[4-(1-hydroxyethyl)-2-methyl-5-nitrophenoxy]-N,N-bis(phenylmethyl)hexanamide IUPAC Name: N,N-dibenzyl-6-[4-(1-hydroxyethyl)-2-methyl-5-nitrophenoxy]hexanamide Traditional Name: N,N-dibenzyl-6-[4-(1-hydroxyethyl)-2-methyl-5-nitro-phenoxy]hexanamide Formula: C29H34N2O5 MolecularWeight: 490.59066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C(C)O)[N+](=O)[O-])OCCCCCC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C(=C1)C(C)O)[N+](=O)[O-])OCCCCCC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C29H34N2O5/c1-22-18-26(23(2)32)27(31(34)35)19-28(22)36-17-11-5-10-16-29(33)30(20-24-12-6-3-7-13-24)21-25-14-8-4-9-15-25/h3-4,6-9,12-15,18-19,23,32H,5,10-11,16-17,20-21H2,1-2H3