[4-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone Openeye Name: [4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone CAS Name: [4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-1-piperazin-4-iumyl]-cyclopropylmethanone IUPAC Name: [4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperazin-4-ium-1-yl]-cyclopropylmethanone Traditional Name: [4-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperazin-4-ium-1-yl]-cyclopropyl-methanone Formula: C17H22ClN2O3+ MolecularWeight: 337.82118

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CC[NH+](CC2)CC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C1CC1C(=O)N2CC[NH+](CC2)CC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C17H21ClN2O3/c18-14-9-12(10-15-16(14)23-8-7-22-15)11-19-3-5-20(6-4-19)17(21)13-1-2-13/h9-10,13H,1-8,11H2/p+1