1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3R)-1-methyl-3-phenyl-pyrrolidin-1-ium-1-yl]butan-1-one

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3R)-1-methyl-3-phenyl-pyrrolidin-1-ium-1-yl]butan-1-one Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3R)-1-methyl-3-phenyl-pyrrolidin-1-ium-1-yl]butan-1-one CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3R)-1-methyl-3-phenyl-1-pyrrolidin-1-iumyl]-1-butanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3R)-1-methyl-3-phenylpyrrolidin-1-ium-1-yl]butan-1-one Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(3R)-1-methyl-3-phenyl-pyrrolidin-1-ium-1-yl]butan-1-one Formula: C23H28NO3+ MolecularWeight: 366.47332

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C1)C2=CC=CC=C2)CCCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[N+]1(CC[C@@H](C1)C2=CC=CC=C2)CCCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H28NO3/c1-24(13-11-20(17-24)18-6-3-2-4-7-18)12-5-8-21(25)19-9-10-22-23(16-19)27-15-14-26-22/h2-4,6-7,9-10,16,20H,5,8,11-15,17H2,1H3/q+1/t20-,24?/m0/s1