8-(azetidin-3-yl)-3,3-dimethyl-2,4-dioxa-8-azaspiro[4.5]decane; 4-methylbenzenesulfonic acid

Systemtic Name: 8-(azetidin-3-yl)-3,3-dimethyl-2,4-dioxa-8-azaspiro[4.5]decane; 4-methylbenzenesulfonic acid Openeye Name: 8-(azetidin-3-yl)-3,3-dimethyl-2,4-dioxa-8-azaspiro[4.5]decane; 4-methylbenzenesulfonic acid CAS Name: 8-(3-azetidinyl)-3,3-dimethyl-2,4-dioxa-8-azaspiro[4.5]decane; 4-methylbenzenesulfonic acid IUPAC Name: 8-(azetidin-3-yl)-3,3-dimethyl-2,4-dioxa-8-azaspiro[4.5]decane; 4-methylbenzenesulfonic acid Traditional Name: 8-(azetidin-3-yl)-3,3-dimethyl-2,4-dioxa-8-azaspiro[4.5]decane; tosylic acid Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1(OCC2(O1)CCN(CC2)C3CNC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1(OCC2(O1)CCN(CC2)C3CNC3)C

InChI

InChI=1S/C12H22N2O2.C7H8O3S/c1-11(2)15-9-12(16-11)3-5-14(6-4-12)10-7-13-8-10;1-6-2-4-7(5-3-6)11(8,9)10/h10,13H,3-9H2,1-2H3;2-5H,1H3,(H,8,9,10)