methyl 2-bromanyl-4-[(3-nitrophenyl)methylcarbamoyl]benzoate

Systemtic Name: methyl 2-bromanyl-4-[(3-nitrophenyl)methylcarbamoyl]benzoate Openeye Name: methyl 2-bromo-4-[(3-nitrophenyl)methylcarbamoyl]benzoate CAS Name: 2-bromo-4-[[(3-nitrophenyl)methylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-bromo-4-[(3-nitrophenyl)methylcarbamoyl]benzoate Traditional Name: 2-bromo-4-[(3-nitrobenzyl)carbamoyl]benzoic acid methyl ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)C(=O)NCC2=CC(=CC=C2)[N+](=O)[O-])Br

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)C(=O)NCC2=CC(=CC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C16H13BrN2O5/c1-24-16(21)13-6-5-11(8-14(13)17)15(20)18-9-10-3-2-4-12(7-10)19(22)23/h2-8H,9H2,1H3,(H,18,20)