[2-[(3,3-dimethyl-7-oxidanylidene-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-(4-hydroxyphenyl)-2-oxidanylidene-ethyl]carbamoyloxymethyl 6-(hydroxymethyl)-3,3-dimethyl-4,4,7-tris(oxidanylidene)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: [2-[(3,3-dimethyl-7-oxidanylidene-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-(4-hydroxyphenyl)-2-oxidanylidene-ethyl]carbamoyloxymethyl 6-(hydroxymethyl)-3,3-dimethyl-4,4,7-tris(oxidanylidene)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: [2-[(2-benzyloxycarbonyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-(4-hydroxyphenyl)-2-oxo-ethyl]carbamoyloxymethyl 6-(hydroxymethyl)-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-(hydroxymethyl)-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid [[[2-[(3,3-dimethyl-7-oxo-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl]amino]-oxomethoxy]methyl ester IUPAC Name: [2-[(3,3-dimethyl-7-oxo-2-phenylmethoxycarbonyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-(4-hydroxyphenyl)-2-oxoethyl]carbamoyloxymethyl 6-(hydroxymethyl)-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 4,4,7-triketo-3,3-dimethyl-6-methylol-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid [2-[(2-carbobenzoxy-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-(4-hydroxyphenyl)-2-keto-ethyl]carbamoyloxymethyl ester Formula: C34H38N4O13S2 MolecularWeight: 774.81452

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)OCOC(=O)C4C(S(=O)(=O)C5N4C(=O)C5CO)(C)C)C(=O)OCC6=CC=CC=C6)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)OCOC(=O)C4C(S(=O)(=O)C5N4C(=O)C5CO)(C)C)C(=O)OCC6=CC=CC=C6)C

InChI

InChI=1S/C34H38N4O13S2/c1-33(2)23(30(44)49-15-17-8-6-5-7-9-17)37-27(43)22(28(37)52-33)35-25(41)21(18-10-12-19(40)13-11-18)36-32(46)51-16-50-31(45)24-34(3,4)53(47,48)29-20(14-39)26(42)38(24)29/h5-13,20-24,28-29,39-40H,14-16H2,1-4H3,(H,35,41)(H,36,46)