(5-bromanyl-2-methoxy-phenyl)methyl 4-azanyl-3-nitro-benzoate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 4-azanyl-3-nitro-benzoate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid (5-bromo-2-methoxy-benzyl) ester Formula: C15H13BrN2O5 MolecularWeight: 381.17812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)COC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)COC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C15H13BrN2O5/c1-22-14-5-3-11(16)6-10(14)8-23-15(19)9-2-4-12(17)13(7-9)18(20)21/h2-7H,8,17H2,1H3