4-chloranyl-3-nitro-4a,5,6,7,8,8a-hexahydrochromen-2-one

Systemtic Name: 4-chloranyl-3-nitro-4a,5,6,7,8,8a-hexahydrochromen-2-one Openeye Name: 4-chloro-3-nitro-4a,5,6,7,8,8a-hexahydrochromen-2-one CAS Name: 4-chloro-3-nitro-4a,5,6,7,8,8a-hexahydro-1-benzopyran-2-one IUPAC Name: 4-chloro-3-nitro-4a,5,6,7,8,8a-hexahydrochromen-2-one Traditional Name: 4-chloro-3-nitro-4a,5,6,7,8,8a-hexahydrochromen-2-one Formula: C9H10ClNO4 MolecularWeight: 231.633

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=C(C(=O)O2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC2C(C1)C(=C(C(=O)O2)[N+](=O)[O-])Cl

InChI

InChI=1S/C9H10ClNO4/c10-7-5-3-1-2-4-6(5)15-9(12)8(7)11(13)14/h5-6H,1-4H2