3-nitroisochromen-1-one

Systemtic Name: 3-nitroisochromen-1-one Openeye Name: 3-nitroisochromen-1-one CAS Name: 3-nitro-2-benzopyran-1-one IUPAC Name: 3-nitroisochromen-1-one Traditional Name: 3-nitroisocoumarin Formula: C9H5NO4 MolecularWeight: 191.1403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(OC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C9H5NO4/c11-9-7-4-2-1-3-6(7)5-8(14-9)10(12)13/h1-5H