4-ethylsulfanyl-3-nitro-chromen-2-one

Systemtic Name: 4-ethylsulfanyl-3-nitro-chromen-2-one Openeye Name: 4-ethylsulfanyl-3-nitro-chromen-2-one CAS Name: 4-(ethylthio)-3-nitro-1-benzopyran-2-one IUPAC Name: 4-ethylsulfanyl-3-nitrochromen-2-one Traditional Name: 4-(ethylthio)-3-nitro-coumarin Formula: C11H9NO4S MolecularWeight: 251.25846

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=O)OC2=CC=CC=C21)[N+](=O)[O-]

Isomeric SMILES

CCSC1=C(C(=O)OC2=CC=CC=C21)[N+](=O)[O-]

InChI

InChI=1S/C11H9NO4S/c1-2-17-10-7-5-3-4-6-8(7)16-11(13)9(10)12(14)15/h3-6H,2H2,1H3