1,3-benzodioxol-5-ylmethyl-cyclopentyl-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-cyclopentyl-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-cyclopentyl-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-oxo-ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-cyclopentyl-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-cyclopentyl-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]azanium Traditional Name: cyclopentyl-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-keto-ethyl]-piperonyl-ammonium Formula: C28H32N3O3+ MolecularWeight: 458.57198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+](CC2=CC3=C(C=C2)OCO3)CC(=O)N4CCC(=CC4)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1CCC(C1)[NH+](CC2=CC3=C(C=C2)OCO3)CC(=O)N4CCC(=CC4)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C28H31N3O3/c32-28(30-13-11-21(12-14-30)24-16-29-25-8-4-3-7-23(24)25)18-31(22-5-1-2-6-22)17-20-9-10-26-27(15-20)34-19-33-26/h3-4,7-11,15-16,22,29H,1-2,5-6,12-14,17-19H2/p+1