2-(4-chloranyl-2-methyl-phenoxy)-N-(2-chloranyl-4-nitro-phenyl)ethanamide hydrate

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-(2-chloranyl-4-nitro-phenyl)ethanamide hydrate Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-(2-chloro-4-nitro-phenyl)acetamide hydrate CAS Name: 2-(4-chloro-2-methylphenoxy)-N-(2-chloro-4-nitrophenyl)acetamide hydrate IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-(2-chloro-4-nitrophenyl)acetamide hydrate Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-(2-chloro-4-nitro-phenyl)acetamide hydrate Formula: C15H14Cl2N2O5 MolecularWeight: 373.18806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.O

InChI

InChI=1S/C15H12Cl2N2O4.H2O/c1-9-6-10(16)2-5-14(9)23-8-15(20)18-13-4-3-11(19(21)22)7-12(13)17;/h2-7H,8H2,1H3,(H,18,20);1H2