[(6R,7S)-7-methoxy-2-[methyl-(phenylmethyl)carbamoyl]-5,5,8-tris(oxidanylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl 4-(2,2-dimethylpropanoyl)benzoate

Systemtic Name: [(6R,7S)-7-methoxy-2-[methyl-(phenylmethyl)carbamoyl]-5,5,8-tris(oxidanylidene)-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl 4-(2,2-dimethylpropanoyl)benzoate Openeye Name: [(6R,7S)-2-[benzyl(methyl)carbamoyl]-7-methoxy-5,5,8-trioxo-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl 4-(2,2-dimethylpropanoyl)benzoate CAS Name: 4-(2,2-dimethyl-1-oxopropyl)benzoic acid [(6R,7S)-7-methoxy-2-[[methyl-(phenylmethyl)amino]-oxomethyl]-5,5,8-trioxo-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl ester IUPAC Name: [(6R,7S)-2-[benzyl(methyl)carbamoyl]-7-methoxy-5,5,8-trioxo-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl 4-(2,2-dimethylpropanoyl)benzoate Traditional Name: 4-pivaloylbenzoic acid [(6R,7S)-2-[benzyl(methyl)carbamoyl]-5,5,8-triketo-7-methoxy-5$l^{6}-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl ester Formula: C29H32N2O8S MolecularWeight: 568.63798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC=C(C=C1)C(=O)OCC2=C(N3C(C(C3=O)OC)S(=O)(=O)C2)C(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)C1=CC=C(C=C1)C(=O)OCC2=C(N3[C@@H]([C@H](C3=O)OC)S(=O)(=O)C2)C(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C29H32N2O8S/c1-29(2,3)24(32)19-11-13-20(14-12-19)28(35)39-16-21-17-40(36,37)27-23(38-5)26(34)31(27)22(21)25(33)30(4)15-18-9-7-6-8-10-18/h6-14,23,27H,15-17H2,1-5H3/t23-,27+/m0/s1