6-nitro-3-(phenylcarbonyl)-3,4-dihydrochromen-2-one

Systemtic Name: 6-nitro-3-(phenylcarbonyl)-3,4-dihydrochromen-2-one Openeye Name: 3-benzoyl-6-nitro-chroman-2-one CAS Name: 3-benzoyl-6-nitro-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 3-benzoyl-6-nitro-3,4-dihydrochromen-2-one Traditional Name: 3-benzoyl-6-nitro-chroman-2-one Formula: C16H11NO5 MolecularWeight: 297.26224

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)OC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

Isomeric SMILES

C1C(C(=O)OC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H11NO5/c18-15(10-4-2-1-3-5-10)13-9-11-8-12(17(20)21)6-7-14(11)22-16(13)19/h1-8,13H,9H2