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

Systemtic Name: 7-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-4-propan-2-yl-chromen-2-one Openeye Name: 4-isopropyl-7-(4-morpholinosulfonyl-2-nitro-phenoxy)chromen-2-one CAS Name: 7-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]-4-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)-4-propan-2-ylchromen-2-one Traditional Name: 4-isopropyl-7-(4-morpholinosulfonyl-2-nitro-phenoxy)coumarin Formula: C22H22N2O8S MolecularWeight: 474.48368

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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)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N2O8S/c1-14(2)18-13-22(25)32-21-11-15(3-5-17(18)21)31-20-6-4-16(12-19(20)24(26)27)33(28,29)23-7-9-30-10-8-23/h3-6,11-14H,7-10H2,1-2H3