1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-methyl-[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]azanium Traditional Name: [(1R)-2-keto-1-phenyl-2-pyrrolidino-ethyl]-methyl-piperonyl-ammonium Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)C(C3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)[C@H](C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C21H24N2O3/c1-22(14-16-9-10-18-19(13-16)26-15-25-18)20(17-7-3-2-4-8-17)21(24)23-11-5-6-12-23/h2-4,7-10,13,20H,5-6,11-12,14-15H2,1H3/p+1/t20-/m1/s1