4-ethyl-6,7-dimethyl-3-nitro-chromen-2-one

Systemtic Name: 4-ethyl-6,7-dimethyl-3-nitro-chromen-2-one Openeye Name: 4-ethyl-6,7-dimethyl-3-nitro-chromen-2-one CAS Name: 4-ethyl-6,7-dimethyl-3-nitro-1-benzopyran-2-one IUPAC Name: 4-ethyl-6,7-dimethyl-3-nitrochromen-2-one Traditional Name: 4-ethyl-6,7-dimethyl-3-nitro-coumarin Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)OC2=CC(=C(C=C21)C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=O)OC2=CC(=C(C=C21)C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H13NO4/c1-4-9-10-5-7(2)8(3)6-11(10)18-13(15)12(9)14(16)17/h5-6H,4H2,1-3H3