[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Traditional Name: (4-piperonylpiperazin-4-ium-1-yl)-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methanone Formula: C24H31N3O3+2 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H29N3O3/c28-24(21-6-3-19(4-7-21)16-25-9-1-2-10-25)27-13-11-26(12-14-27)17-20-5-8-22-23(15-20)30-18-29-22/h3-8,15H,1-2,9-14,16-18H2/p+2