6-[(4-bromophenyl)carbonylamino]-3-ethanoyl-7-oxidanylidene-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-[(4-bromophenyl)carbonylamino]-3-ethanoyl-7-oxidanylidene-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 3-acetyl-6-[(4-bromobenzoyl)amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3-acetyl-6-[[(4-bromophenyl)-oxomethyl]amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3-acetyl-6-[(4-bromobenzoyl)amino]-7-oxo-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 3-acetyl-6-[(4-bromobenzoyl)amino]-7-keto-1,3-diazabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C15H14BrN3O5 MolecularWeight: 396.19276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2C(C(=O)N2C1C(=O)O)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)N1CC2C(C(=O)N2C1C(=O)O)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H14BrN3O5/c1-7(20)18-6-10-11(14(22)19(10)13(18)15(23)24)17-12(21)8-2-4-9(16)5-3-8/h2-5,10-11,13H,6H2,1H3,(H,17,21)(H,23,24)