[(6Z)-9-bicyclo[6.1.0]non-6-enyl]azanium; 4-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: [(6Z)-9-bicyclo[6.1.0]non-6-enyl]azanium; 4-oxidanyl-4-oxidanylidene-butanoate Openeye Name: [(6Z)-9-bicyclo[6.1.0]non-6-enyl]ammonium; 4-hydroxy-4-oxo-butanoate CAS Name: [(6Z)-9-bicyclo[6.1.0]non-6-enyl]ammonium; 4-hydroxy-4-oxobutanoate IUPAC Name: [(6Z)-9-bicyclo[6.1.0]non-6-enyl]azanium; 4-hydroxy-4-oxobutanoate Traditional Name: [(6Z)-9-bicyclo[6.1.0]non-6-enyl]ammonium; 4-hydroxy-4-keto-butyrate Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C2[NH3+])C=CC1.C(CC(=O)[O-])C(=O)O

Isomeric SMILES

C1CCC2C(C2[NH3+])/C=C\C1.C(CC(=O)[O-])C(=O)O

InChI

InChI=1S/C9H15N.C4H6O4/c10-9-7-5-3-1-2-4-6-8(7)9;5-3(6)1-2-4(7)8/h3,5,7-9H,1-2,4,6,10H2;1-2H2,(H,5,6)(H,7,8)/b5-3-;