3-methyl-3-nitroso-1-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1H-inden-1-yl]hexane-2,4-dione

Systemtic Name: 3-methyl-3-nitroso-1-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1H-inden-1-yl]hexane-2,4-dione Openeye Name: 1-[4-[2-hydroxy-3-(isopropylamino)propoxy]indan-1-yl]-3-methyl-3-nitroso-hexane-2,4-dione CAS Name: 1-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1H-inden-1-yl]-3-methyl-3-nitrosohexane-2,4-dione IUPAC Name: 1-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3-dihydro-1H-inden-1-yl]-3-methyl-3-nitrosohexane-2,4-dione Traditional Name: 1-[4-[2-hydroxy-3-(isopropylamino)propoxy]indan-1-yl]-3-methyl-3-nitroso-hexane-2,4-dione Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)(C(=O)CC1CCC2=C1C=CC=C2OCC(CNC(C)C)O)N=O

Isomeric SMILES

CCC(=O)C(C)(C(=O)CC1CCC2=C1C=CC=C2OCC(CNC(C)C)O)N=O

InChI

InChI=1S/C22H32N2O5/c1-5-20(26)22(4,24-28)21(27)11-15-9-10-18-17(15)7-6-8-19(18)29-13-16(25)12-23-14(2)3/h6-8,14-16,23,25H,5,9-13H2,1-4H3