methyl 2-[(4-bromanyl-2-nitro-phenyl)carbonyl-tert-butyl-amino]ethanoate

Systemtic Name: methyl 2-[(4-bromanyl-2-nitro-phenyl)carbonyl-tert-butyl-amino]ethanoate Openeye Name: methyl 2-[(4-bromo-2-nitro-benzoyl)-tert-butyl-amino]acetate CAS Name: 2-[[(4-bromo-2-nitrophenyl)-oxomethyl]-tert-butylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-nitrobenzoyl)-tert-butylamino]acetate Traditional Name: 2-[(4-bromo-2-nitro-benzoyl)-tert-butyl-amino]acetic acid methyl ester Formula: C14H17BrN2O5 MolecularWeight: 373.19918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrN2O5/c1-14(2,3)16(8-12(18)22-4)13(19)10-6-5-9(15)7-11(10)17(20)21/h5-7H,8H2,1-4H3