(4-methoxyphenyl)methyl (6R,7R)-3-[(E)-2-[(5R)-2-methyl-1,2-oxazolidin-5-yl]ethenyl]-8-oxidanylidene-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (6R,7R)-3-[(E)-2-[(5R)-2-methyl-1,2-oxazolidin-5-yl]ethenyl]-8-oxidanylidene-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl (6R,7R)-3-[(E)-2-[(5R)-2-methylisoxazolidin-5-yl]vinyl]-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6R,7R)-3-[(E)-2-[(5R)-2-methyl-5-isoxazolidinyl]ethenyl]-8-oxo-7-[(1-oxo-2-phenylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (6R,7R)-3-[(E)-2-[(5R)-2-methyl-1,2-oxazolidin-5-yl]ethenyl]-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6R,7R)-8-keto-3-[(E)-2-[(5R)-2-methylisoxazolidin-5-yl]vinyl]-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid p-anisyl ester Formula: C29H31N3O6S MolecularWeight: 549.63794

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(O1)C=CC2=C(N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)OCC5=CC=C(C=C5)OC

Isomeric SMILES

CN1CC[C@@H](O1)/C=C/C2=C(N3[C@@H]([C@@H](C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)OCC5=CC=C(C=C5)OC

InChI

InChI=1S/C29H31N3O6S/c1-31-15-14-23(38-31)13-10-21-18-39-28-25(30-24(33)16-19-6-4-3-5-7-19)27(34)32(28)26(21)29(35)37-17-20-8-11-22(36-2)12-9-20/h3-13,23,25,28H,14-18H2,1-2H3,(H,30,33)/b13-10+/t23-,25+,28+/m0/s1