1,3-benzodioxol-5-ylmethyl-[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxidanylidene-propyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxidanylidene-propyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-3-ethoxy-3-oxo-1-(p-tolyl)propyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxopropyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(1R)-3-ethoxy-1-(4-methylphenyl)-3-oxopropyl]azanium Traditional Name: [(1R)-3-ethoxy-3-keto-1-(p-tolyl)propyl]-piperonyl-ammonium Formula: C20H24NO4+ MolecularWeight: 342.40886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)C)[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C[C@H](C1=CC=C(C=C1)C)[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H23NO4/c1-3-23-20(22)11-17(16-7-4-14(2)5-8-16)21-12-15-6-9-18-19(10-15)25-13-24-18/h4-10,17,21H,3,11-13H2,1-2H3/p+1/t17-/m1/s1