7-[3-(1-hydroxyethyl)-2-methyl-4-nitro-phenoxy]-N-methyl-N-phenyl-heptanamide

Systemtic Name: 7-[3-(1-hydroxyethyl)-2-methyl-4-nitro-phenoxy]-N-methyl-N-phenyl-heptanamide Openeye Name: 7-[3-(1-hydroxyethyl)-2-methyl-4-nitro-phenoxy]-N-methyl-N-phenyl-heptanamide CAS Name: 7-[3-(1-hydroxyethyl)-2-methyl-4-nitrophenoxy]-N-methyl-N-phenylheptanamide IUPAC Name: 7-[3-(1-hydroxyethyl)-2-methyl-4-nitrophenoxy]-N-methyl-N-phenylheptanamide Traditional Name: 7-[3-(1-hydroxyethyl)-2-methyl-4-nitro-phenoxy]-N-methyl-N-phenyl-enanthamide Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O5/c1-17-21(15-14-20(25(28)29)23(17)18(2)26)30-16-10-5-4-9-13-22(27)24(3)19-11-7-6-8-12-19/h6-8,11-12,14-15,18,26H,4-5,9-10,13,16H2,1-3H3