methyl 3-bromanyl-4-(4-hydroxyphenyl)-5-nitro-benzoate

Systemtic Name: methyl 3-bromanyl-4-(4-hydroxyphenyl)-5-nitro-benzoate Openeye Name: methyl 3-bromo-4-(4-hydroxyphenyl)-5-nitro-benzoate CAS Name: 3-bromo-4-(4-hydroxyphenyl)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-(4-hydroxyphenyl)-5-nitrobenzoate Traditional Name: 3-bromo-4-(4-hydroxyphenyl)-5-nitro-benzoic acid methyl ester Formula: C14H10BrNO5 MolecularWeight: 352.1369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrNO5/c1-21-14(18)9-6-11(15)13(12(7-9)16(19)20)8-2-4-10(17)5-3-8/h2-7,17H,1H3