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

Systemtic Name: (10bS)-1'-propan-2-yl-2-thiophen-2-yl-spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Openeye Name: (10bS)-1'-isopropyl-2-(2-thienyl)spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] CAS Name: (10bS)-1'-propan-2-yl-2-thiophen-2-ylspiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] IUPAC Name: (10bS)-1'-propan-2-yl-2-thiophen-2-ylspiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Traditional Name: (10bS)-1'-isopropyl-2-(2-thienyl)spiro[3,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidin-1-ium] Formula: C21H26N3OS+ MolecularWeight: 368.51564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC2(CC1)N3C(C=C(N3)C4=CC=CS4)C5=CC=CC=C5O2

Isomeric SMILES

CC(C)[NH+]1CCC2(CC1)N3[C@@H](C=C(N3)C4=CC=CS4)C5=CC=CC=C5O2

InChI

InChI=1S/C21H25N3OS/c1-15(2)23-11-9-21(10-12-23)24-18(16-6-3-4-7-19(16)25-21)14-17(22-24)20-8-5-13-26-20/h3-8,13-15,18,22H,9-12H2,1-2H3/p+1/t18-/m0/s1