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7-nitro-2-(2-oxidanylidenepropoxy)-1,4-dihydroisoquinolin-3-one

7-nitro-2-(2-oxidanylidenepropoxy)-1,4-dihydroisoquinolin-3-one

Systemtic Name:7-nitro-2-(2-oxidanylidenepropoxy)-1,4-dihydroisoquinolin-3-one
Openeye Name:2-acetonyloxy-7-nitro-1,4-dihydroisoquinolin-3-one
CAS Name:7-nitro-2-(2-oxopropoxy)-1,4-dihydroisoquinolin-3-one
IUPAC Name:7-nitro-2-(2-oxopropoxy)-1,4-dihydroisoquinolin-3-one
Traditional Name:2-acetonyloxy-7-nitro-1,4-dihydroisoquinolin-3-one
Formula: C12H12N2O5
MolecularWeight: 264.23408
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CON1CC2=C(CC1=O)C=CC(=C2)[N+](=O)[O-]


Isomeric SMILES

CC(=O)CON1CC2=C(CC1=O)C=CC(=C2)[N+](=O)[O-]


InChI

InChI=1S/C12H12N2O5/c1-8(15)7-19-13-6-10-4-11(14(17)18)3-2-9(10)5-12(13)16/h2-4H,5-7H2,1H3


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