3-(6-azaniumyl-2-methyl-hexan-2-yl)-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 3-(6-azaniumyl-2-methyl-hexan-2-yl)-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-(5-azaniumyl-1,1-dimethyl-pentyl)-6-[(1R)-1-hydroxyethyl]-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(6-ammonio-2-methylhexan-2-yl)-6-[(1R)-1-hydroxyethyl]-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-(6-azaniumyl-2-methylhexan-2-yl)-6-[(1R)-1-hydroxyethyl]-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-(5-ammonio-1,1-dimethyl-pentyl)-6-[(1R)-1-hydroxyethyl]-7-keto-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C15H24N2O5 MolecularWeight: 312.36146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(O2)C(C)(C)CCCC[NH3+])C(=O)[O-])O

Isomeric SMILES

C[C@H](C1C2N(C1=O)C(=C(O2)C(C)(C)CCCC[NH3+])C(=O)[O-])O

InChI

InChI=1S/C15H24N2O5/c1-8(18)9-12(19)17-10(14(20)21)11(22-13(9)17)15(2,3)6-4-5-7-16/h8-9,13,18H,4-7,16H2,1-3H3,(H,20,21)/t8-,9?,13?/m1/s1