(10bR)-2-(1,3-benzodioxol-5-yl)-7-methoxy-1'-methyl-spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium]

Systemtic Name: (10bR)-2-(1,3-benzodioxol-5-yl)-7-methoxy-1'-methyl-spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Openeye Name: (10bR)-2-(1,3-benzodioxol-5-yl)-7-methoxy-1'-methyl-spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] CAS Name: (10bR)-2-(1,3-benzodioxol-5-yl)-7-methoxy-1'-methylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] IUPAC Name: (10bR)-2-(1,3-benzodioxol-5-yl)-7-methoxy-1'-methylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Traditional Name: (10bR)-2-(1,3-benzodioxol-5-yl)-7-methoxy-1'-methyl-spiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Formula: C23H26N3O4+ MolecularWeight: 408.47024

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2(CC1)N3C(CC(=N3)C4=CC5=C(C=C4)OCO5)C6=C(O2)C(=CC=C6)OC

Isomeric SMILES

C[NH+]1CCC2(CC1)N3[C@H](CC(=N3)C4=CC5=C(C=C4)OCO5)C6=C(O2)C(=CC=C6)OC

InChI

InChI=1S/C23H25N3O4/c1-25-10-8-23(9-11-25)26-18(16-4-3-5-20(27-2)22(16)30-23)13-17(24-26)15-6-7-19-21(12-15)29-14-28-19/h3-7,12,18H,8-11,13-14H2,1-2H3/p+1/t18-/m1/s1