[nitro(phenyl)methyl] 3-[(5-methoxycarbonyl-1,2,3-triazol-1-yl)methyl]-3-methyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: [nitro(phenyl)methyl] 3-[(5-methoxycarbonyl-1,2,3-triazol-1-yl)methyl]-3-methyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: [nitro(phenyl)methyl] 3-[(5-methoxycarbonyltriazol-1-yl)methyl]-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3-[(5-methoxycarbonyl-1-triazolyl)methyl]-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid [nitro(phenyl)methyl] ester IUPAC Name: [nitro(phenyl)methyl] 3-[(5-methoxycarbonyltriazol-1-yl)methyl]-3-methyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 3-[(5-carbomethoxytriazol-1-yl)methyl]-7-keto-3-methyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid [nitro(phenyl)methyl] ester Formula: C19H19N5O7S MolecularWeight: 461.44846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N5O7S/c1-19(10-22-12(9-20-21-22)17(26)30-2)15(23-13(25)8-14(23)32-19)18(27)31-16(24(28)29)11-6-4-3-5-7-11/h3-7,9,14-16H,8,10H2,1-2H3