(4-nitrophenyl)methyl (5R,6S)-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-3-[(5R)-3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl (5R,6S)-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-3-[(5R)-3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: (4-nitrophenyl)methyl (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(5R)-3-(3-pyridyl)-4,5-dihydroisoxazol-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(5R)-3-(3-pyridinyl)-4,5-dihydroisoxazol-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-3-[(5R)-3-pyridin-3-yl-4,5-dihydro-1,2-oxazol-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: (5R,6S)-6-[(1R)-1-hydroxyethyl]-7-keto-3-[(5R)-3-(3-pyridyl)-2-isoxazolin-5-yl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (4-nitrobenzyl) ester Formula: C24H22N4O7 MolecularWeight: 478.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])C4CC(=NO4)C5=CN=CC=C5)O

Isomeric SMILES

C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])[C@H]4CC(=NO4)C5=CN=CC=C5)O

InChI

InChI=1S/C24H22N4O7/c1-13(29)21-19-9-17(20-10-18(26-35-20)15-3-2-8-25-11-15)22(27(19)23(21)30)24(31)34-12-14-4-6-16(7-5-14)28(32)33/h2-8,11,13,19-21,29H,9-10,12H2,1H3/t13-,19-,20-,21-/m1/s1