1-azabicyclo[4.2.0]oct-2-ene; 2,4-dimethylbenzoic acid

Systemtic Name: 1-azabicyclo[4.2.0]oct-2-ene; 2,4-dimethylbenzoic acid Openeye Name: 1-azabicyclo[4.2.0]oct-2-ene; 2,4-dimethylbenzoic acid CAS Name: 1-azabicyclo[4.2.0]oct-2-ene; 2,4-dimethylbenzoic acid IUPAC Name: 1-azabicyclo[4.2.0]oct-2-ene; 2,4-dimethylbenzoic acid Traditional Name: 1-azabicyclo[4.2.0]oct-2-ene; 2,4-xylic acid Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)O)C.C1CC2CCN2C=C1

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)O)C.C1CC2CCN2C=C1

InChI

InChI=1S/C9H10O2.C7H11N/c1-6-3-4-8(9(10)11)7(2)5-6;1-2-5-8-6-4-7(8)3-1/h3-5H,1-2H3,(H,10,11);2,5,7H,1,3-4,6H2