(diphenylmethyl) (6S)-7-[[(2Z)-4-bromanyl-3-oxidanylidene-2-(2-oxidanylidene-2-phenylmethoxy-ethoxy)imino-butanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (6S)-7-[[(2Z)-4-bromanyl-3-oxidanylidene-2-(2-oxidanylidene-2-phenylmethoxy-ethoxy)imino-butanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl (6S)-7-[[(2Z)-2-(2-benzyloxy-2-oxo-ethoxy)imino-4-bromo-3-oxo-butanoyl]amino]-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6S)-7-[[(2Z)-4-bromo-1,3-dioxo-2-(2-oxo-2-phenylmethoxyethoxy)iminobutyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (6S)-7-[[(2Z)-4-bromo-3-oxo-2-(2-oxo-2-phenylmethoxyethoxy)iminobutanoyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6S)-7-[[(2Z)-2-(2-benzoxy-2-keto-ethyl)oximino-4-bromo-3-keto-butanoyl]amino]-8-keto-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C35H30BrN3O8S MolecularWeight: 732.597

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=C(N2C(C(C2=O)NC(=O)C(=NOCC(=O)OCC3=CC=CC=C3)C(=O)CBr)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CC1=C(N2[C@H](C(C2=O)NC(=O)/C(=N\OCC(=O)OCC3=CC=CC=C3)/C(=O)CBr)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C35H30BrN3O8S/c1-2-23-21-48-34-29(37-32(42)28(26(40)18-36)38-46-20-27(41)45-19-22-12-6-3-7-13-22)33(43)39(34)30(23)35(44)47-31(24-14-8-4-9-15-24)25-16-10-5-11-17-25/h2-17,29,31,34H,1,18-21H2,(H,37,42)/b38-28-/t29?,34-/m0/s1