5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxylate

Systemtic Name: 5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxylate Openeye Name: 5,6,7,8-tetrahydro-4H-cyclohepta[d]isoxazole-3-carboxylate CAS Name: 5,6,7,8-tetrahydro-4H-cyclohepta[d]isoxazole-3-carboxylate IUPAC Name: 5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxylate Traditional Name: 5,6,7,8-tetrahydro-4H-cyclohept[d]isoxazole-3-carboxylate Formula: C9H10NO3- MolecularWeight: 180.1806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)ON=C2C(=O)[O-]

Isomeric SMILES

C1CCC2=C(CC1)ON=C2C(=O)[O-]

InChI

InChI=1S/C9H11NO3/c11-9(12)8-6-4-2-1-3-5-7(6)13-10-8/h1-5H2,(H,11,12)/p-1