(10bS)-2-(3-methoxyphenyl)-1'-methyl-spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium]

Systemtic Name: (10bS)-2-(3-methoxyphenyl)-1'-methyl-spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Openeye Name: (10bS)-2-(3-methoxyphenyl)-1'-methyl-spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] CAS Name: (10bS)-2-(3-methoxyphenyl)-1'-methylspiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] IUPAC Name: (10bS)-2-(3-methoxyphenyl)-1'-methylspiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Traditional Name: (10bS)-2-(3-methoxyphenyl)-1'-methyl-spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2(CC1)N3C(C=C(N3)C4=CC(=CC=C4)OC)C5=CC=CC=C5O2

Isomeric SMILES

C[NH+]1CCC2(CC1)N3[C@@H](C=C(N3)C4=CC(=CC=C4)OC)C5=CC=CC=C5O2

InChI

InChI=1S/C22H25N3O2/c1-24-12-10-22(11-13-24)25-20(18-8-3-4-9-21(18)27-22)15-19(23-25)16-6-5-7-17(14-16)26-2/h3-9,14-15,20,23H,10-13H2,1-2H3/p+1/t20-/m0/s1