7-(4-methylsulfonyl-2-nitro-phenoxy)-4-propan-2-yl-chromen-2-one

Systemtic Name: 7-(4-methylsulfonyl-2-nitro-phenoxy)-4-propan-2-yl-chromen-2-one Openeye Name: 4-isopropyl-7-(4-methylsulfonyl-2-nitro-phenoxy)chromen-2-one CAS Name: 7-(4-methylsulfonyl-2-nitrophenoxy)-4-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-(4-methylsulfonyl-2-nitrophenoxy)-4-propan-2-ylchromen-2-one Traditional Name: 4-isopropyl-7-(4-mesyl-2-nitro-phenoxy)coumarin Formula: C19H17NO7S MolecularWeight: 403.40578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO7S/c1-11(2)15-10-19(21)27-18-8-12(4-6-14(15)18)26-17-7-5-13(28(3,24)25)9-16(17)20(22)23/h4-11H,1-3H3