2-[(4-bromanyl-2-nitro-phenyl)methyl-(4-chlorophenyl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[(4-bromanyl-2-nitro-phenyl)methyl-(4-chlorophenyl)carbonyl-amino]ethanoic acid Openeye Name: 2-[(4-bromo-2-nitro-phenyl)methyl-(4-chlorobenzoyl)amino]acetic acid CAS Name: 2-[(4-bromo-2-nitrophenyl)methyl-[(4-chlorophenyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-bromo-2-nitrophenyl)methyl-(4-chlorobenzoyl)amino]acetic acid Traditional Name: 2-[(4-bromo-2-nitro-benzyl)-(4-chlorobenzoyl)amino]acetic acid Formula: C16H12BrClN2O5 MolecularWeight: 427.63388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N(CC2=C(C=C(C=C2)Br)[N+](=O)[O-])CC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)N(CC2=C(C=C(C=C2)Br)[N+](=O)[O-])CC(=O)O)Cl

InChI

InChI=1S/C16H12BrClN2O5/c17-12-4-1-11(14(7-12)20(24)25)8-19(9-15(21)22)16(23)10-2-5-13(18)6-3-10/h1-7H,8-9H2,(H,21,22)