4,8-dimethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one

Systemtic Name: 4,8-dimethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one Openeye Name: 4,8-dimethyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one CAS Name: 4,8-dimethyl-7-(4-methylsulfonyl-2-nitrophenoxy)-1-benzopyran-2-one IUPAC Name: 4,8-dimethyl-7-(4-methylsulfonyl-2-nitrophenoxy)chromen-2-one Traditional Name: 7-(4-mesyl-2-nitro-phenoxy)-4,8-dimethyl-coumarin Formula: C18H15NO7S MolecularWeight: 389.3792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

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