[(3S)-3-(1,3-benzodioxol-5-yloxy)-3-(4-methylphenyl)propyl]azanium

Systemtic Name: [(3S)-3-(1,3-benzodioxol-5-yloxy)-3-(4-methylphenyl)propyl]azanium Openeye Name: [(3S)-3-(1,3-benzodioxol-5-yloxy)-3-(p-tolyl)propyl]ammonium CAS Name: [(3S)-3-(1,3-benzodioxol-5-yloxy)-3-(4-methylphenyl)propyl]ammonium IUPAC Name: [(3S)-3-(1,3-benzodioxol-5-yloxy)-3-(4-methylphenyl)propyl]azanium Traditional Name: [(3S)-3-(1,3-benzodioxol-5-yloxy)-3-(p-tolyl)propyl]ammonium Formula: C17H20NO3+ MolecularWeight: 286.3456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC[NH3+])OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CC[NH3+])OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19NO3/c1-12-2-4-13(5-3-12)15(8-9-18)21-14-6-7-16-17(10-14)20-11-19-16/h2-7,10,15H,8-9,11,18H2,1H3/p+1/t15-/m0/s1