N-[2,6-bis(chloranyl)-3-methyl-phenyl]-4-(4-methoxy-2-nitro-phenoxy)butanamide

Systemtic Name: N-[2,6-bis(chloranyl)-3-methyl-phenyl]-4-(4-methoxy-2-nitro-phenoxy)butanamide Openeye Name: N-(2,6-dichloro-3-methyl-phenyl)-4-(4-methoxy-2-nitro-phenoxy)butanamide CAS Name: N-(2,6-dichloro-3-methylphenyl)-4-(4-methoxy-2-nitrophenoxy)butanamide IUPAC Name: N-(2,6-dichloro-3-methylphenyl)-4-(4-methoxy-2-nitrophenoxy)butanamide Traditional Name: N-(2,6-dichloro-3-methyl-phenyl)-4-(4-methoxy-2-nitro-phenoxy)butyramide Formula: C18H18Cl2N2O5 MolecularWeight: 413.25192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)CCCOC2=C(C=C(C=C2)OC)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)CCCOC2=C(C=C(C=C2)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18Cl2N2O5/c1-11-5-7-13(19)18(17(11)20)21-16(23)4-3-9-27-15-8-6-12(26-2)10-14(15)22(24)25/h5-8,10H,3-4,9H2,1-2H3,(H,21,23)