[3,3-dimethyl-7,8-bis(oxidanyl)-1-oxidanylidene-4-oxa-2-azaspiro[4.5]decan-9-yl] benzoate

Systemtic Name: [3,3-dimethyl-7,8-bis(oxidanyl)-1-oxidanylidene-4-oxa-2-azaspiro[4.5]decan-9-yl] benzoate Openeye Name: (7,8-dihydroxy-3,3-dimethyl-1-oxo-4-oxa-2-azaspiro[4.5]decan-9-yl) benzoate CAS Name: benzoic acid (7,8-dihydroxy-3,3-dimethyl-1-oxo-4-oxa-2-azaspiro[4.5]decan-9-yl) ester IUPAC Name: (7,8-dihydroxy-3,3-dimethyl-1-oxo-4-oxa-2-azaspiro[4.5]decan-9-yl) benzoate Traditional Name: benzoic acid (7,8-dihydroxy-1-keto-3,3-dimethyl-4-oxa-2-azaspiro[4.5]decan-9-yl) ester Formula: C17H21NO6 MolecularWeight: 335.35174

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NC(=O)C2(O1)CC(C(C(C2)OC(=O)C3=CC=CC=C3)O)O)C

Isomeric SMILES

CC1(NC(=O)C2(O1)CC(C(C(C2)OC(=O)C3=CC=CC=C3)O)O)C

InChI

InChI=1S/C17H21NO6/c1-16(2)18-15(22)17(24-16)8-11(19)13(20)12(9-17)23-14(21)10-6-4-3-5-7-10/h3-7,11-13,19-20H,8-9H2,1-2H3,(H,18,22)