methyl 2-nitro-5-(2-phenylmethoxyethoxy)benzoate

Systemtic Name: methyl 2-nitro-5-(2-phenylmethoxyethoxy)benzoate Openeye Name: methyl 5-(2-benzyloxyethoxy)-2-nitro-benzoate CAS Name: 2-nitro-5-(2-phenylmethoxyethoxy)benzoic acid methyl ester IUPAC Name: methyl 2-nitro-5-(2-phenylmethoxyethoxy)benzoate Traditional Name: 5-(2-benzoxyethoxy)-2-nitro-benzoic acid methyl ester Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)OCCOCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)OCCOCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17NO6/c1-22-17(19)15-11-14(7-8-16(15)18(20)21)24-10-9-23-12-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3