1-(2,3-dihydro-1H-inden-5-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanone Openeye Name: 1-indan-5-yl-2-(4-morpholinosulfonyl-2-nitro-phenoxy)ethanone CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]ethanone IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)ethanone Traditional Name: 1-indan-5-yl-2-(4-morpholinosulfonyl-2-nitro-phenoxy)ethanone Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O7S/c24-20(17-5-4-15-2-1-3-16(15)12-17)14-30-21-7-6-18(13-19(21)23(25)26)31(27,28)22-8-10-29-11-9-22/h4-7,12-13H,1-3,8-11,14H2