(1-azanyl-1-oxidanylidene-propan-2-yl) 4-(4-chloranyl-2-nitro-phenoxy)benzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 4-(4-chloranyl-2-nitro-phenoxy)benzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 4-(4-chloro-2-nitro-phenoxy)benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)benzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 4-(4-chloro-2-nitrophenoxy)benzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C16H13ClN2O6 MolecularWeight: 364.73722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN2O6/c1-9(15(18)20)24-16(21)10-2-5-12(6-3-10)25-14-7-4-11(17)8-13(14)19(22)23/h2-9H,1H3,(H2,18,20)