(4-nitrophenyl)methyl (2S,3S,5S)-3-[(5-methoxycarbonyl-1,2,3-triazol-1-yl)methyl]-3-methyl-4,4,7-tris(oxidanylidene)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl (2S,3S,5S)-3-[(5-methoxycarbonyl-1,2,3-triazol-1-yl)methyl]-3-methyl-4,4,7-tris(oxidanylidene)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: (4-nitrophenyl)methyl (2S,3S,5S)-3-[(5-methoxycarbonyltriazol-1-yl)methyl]-3-methyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: (2S,3S,5S)-3-[(5-methoxycarbonyl-1-triazolyl)methyl]-3-methyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2S,3S,5S)-3-[(5-methoxycarbonyltriazol-1-yl)methyl]-3-methyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: (2S,3S,5S)-3-[(5-carbomethoxytriazol-1-yl)methyl]-4,4,7-triketo-3-methyl-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (4-nitrobenzyl) ester Formula: C19H19N5O9S MolecularWeight: 493.44726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1(=O)=O)CC2=O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])CN4C(=CN=N4)C(=O)OC

Isomeric SMILES

C[C@@]1([C@@H](N2[C@@H](S1(=O)=O)CC2=O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])CN4C(=CN=N4)C(=O)OC

InChI

InChI=1S/C19H19N5O9S/c1-19(10-22-13(8-20-21-22)17(26)32-2)16(23-14(25)7-15(23)34(19,30)31)18(27)33-9-11-3-5-12(6-4-11)24(28)29/h3-6,8,15-16H,7,9-10H2,1-2H3/t15-,16-,19-/m0/s1