3-nitro-4-oxidanyl-spiro[3,4-dihydrochromene-2,2'-cycloheptane]-1'-one

Systemtic Name: 3-nitro-4-oxidanyl-spiro[3,4-dihydrochromene-2,2'-cycloheptane]-1'-one Openeye Name: 4-hydroxy-3-nitro-spiro[chromane-2,2'-cycloheptane]-1'-one CAS Name: 4-hydroxy-3-nitro-1'-spiro[3,4-dihydro-2H-1-benzopyran-2,2'-cycloheptane]one IUPAC Name: 4-hydroxy-3-nitrospiro[3,4-dihydrochromene-2,2'-cycloheptane]-1'-one Traditional Name: 4-hydroxy-3-nitro-spiro[chroman-2,2'-cycloheptane]-1'-one Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C2(CC1)C(C(C3=CC=CC=C3O2)O)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=O)C2(CC1)C(C(C3=CC=CC=C3O2)O)[N+](=O)[O-]

InChI

InChI=1S/C15H17NO5/c17-12-8-2-1-5-9-15(12)14(16(19)20)13(18)10-6-3-4-7-11(10)21-15/h3-4,6-7,13-14,18H,1-2,5,8-9H2