(2-azanyl-2-oxidanylidene-ethyl) 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C16H13ClN2O7 MolecularWeight: 380.73662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC(=O)N)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC(=O)N)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN2O7/c1-24-14-6-9(16(21)25-8-15(18)20)2-4-13(14)26-12-5-3-10(17)7-11(12)19(22)23/h2-7H,8H2,1H3,(H2,18,20)