[(2R)-4-(1,3-benzodioxol-5-yl)-2-methyl-2-thiomorpholin-4-yl-butyl]azanium

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)-2-methyl-2-thiomorpholin-4-yl-butyl]azanium Openeye Name: [(2R)-4-(1,3-benzodioxol-5-yl)-2-methyl-2-thiomorpholino-butyl]ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)-2-methyl-2-thiomorpholin-4-ylbutyl]ammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)-2-methyl-2-thiomorpholin-4-ylbutyl]azanium Traditional Name: [(2R)-4-(1,3-benzodioxol-5-yl)-2-methyl-2-thiomorpholino-butyl]ammonium Formula: C16H25N2O2S+ MolecularWeight: 309.4469

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)(C[NH3+])N3CCSCC3

Isomeric SMILES

C[C@@](CCC1=CC2=C(C=C1)OCO2)(C[NH3+])N3CCSCC3

InChI

InChI=1S/C16H24N2O2S/c1-16(11-17,18-6-8-21-9-7-18)5-4-13-2-3-14-15(10-13)20-12-19-14/h2-3,10H,4-9,11-12,17H2,1H3/p+1/t16-/m1/s1