[(3S)-1-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(6-methyl-1,3-benzodioxol-5-yl)methyl]-3-pyrrolidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-1-ium-3-yl]methanol Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C[NH+]3CCC(C3)CO)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1C[NH+]3CC[C@@H](C3)CO)OCO2

InChI

InChI=1S/C14H19NO3/c1-10-4-13-14(18-9-17-13)5-12(10)7-15-3-2-11(6-15)8-16/h4-5,11,16H,2-3,6-9H2,1H3/p+1/t11-/m0/s1