7-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)-4-propan-2-yl-chromen-2-one

Systemtic Name: 7-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)-4-propan-2-yl-chromen-2-one Openeye Name: 4-isopropyl-7-[2-nitro-4-(1-piperidylsulfonyl)phenoxy]chromen-2-one CAS Name: 7-[2-nitro-4-(1-piperidinylsulfonyl)phenoxy]-4-propan-2-yl-1-benzopyran-2-one IUPAC Name: 7-(2-nitro-4-piperidin-1-ylsulfonylphenoxy)-4-propan-2-ylchromen-2-one Traditional Name: 4-isopropyl-7-(2-nitro-4-piperidinosulfonyl-phenoxy)coumarin Formula: C23H24N2O7S MolecularWeight: 472.51086

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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)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N2O7S/c1-15(2)19-14-23(26)32-22-12-16(6-8-18(19)22)31-21-9-7-17(13-20(21)25(27)28)33(29,30)24-10-4-3-5-11-24/h6-9,12-15H,3-5,10-11H2,1-2H3