3-[5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-oxidanyl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-nitroso-butan-2-one

Systemtic Name: 3-[5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-oxidanyl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-nitroso-butan-2-one Openeye Name: 3-[5-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-hydroxy-tetralin-2-yl]-3-nitroso-butan-2-one CAS Name: 3-[5-[3-(tert-butylamino)-2-hydroxypropoxy]-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]-3-nitroso-2-butanone IUPAC Name: 3-[5-[3-(tert-butylamino)-2-hydroxypropoxy]-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]-3-nitrosobutan-2-one Traditional Name: 3-[5-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-hydroxy-tetralin-2-yl]-3-nitroso-butan-2-one Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C1CC2=C(CC1O)C(=CC=C2)OCC(CNC(C)(C)C)O)N=O

Isomeric SMILES

CC(=O)C(C)(C1CC2=C(CC1O)C(=CC=C2)OCC(CNC(C)(C)C)O)N=O

InChI

InChI=1S/C21H32N2O5/c1-13(24)21(5,23-27)17-9-14-7-6-8-19(16(14)10-18(17)26)28-12-15(25)11-22-20(2,3)4/h6-8,15,17-18,22,25-26H,9-12H2,1-5H3