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4-ethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one

4-ethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one

Systemtic Name:4-ethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one
Openeye Name:4-ethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one
CAS Name:4-ethyl-7-(4-methylsulfonyl-2-nitrophenoxy)-1-benzopyran-2-one
IUPAC Name:4-ethyl-7-(4-methylsulfonyl-2-nitrophenoxy)chromen-2-one
Traditional Name:4-ethyl-7-(4-mesyl-2-nitro-phenoxy)coumarin
Formula: C18H15NO7S
MolecularWeight: 389.3792
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]


Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]


InChI

InChI=1S/C18H15NO7S/c1-3-11-8-18(20)26-17-9-12(4-6-14(11)17)25-16-7-5-13(27(2,23)24)10-15(16)19(21)22/h4-10H,3H2,1-2H3


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