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

Systemtic Name: 1-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Formula: C20H24ClN2O3+ MolecularWeight: 375.86916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C20H23ClN2O3/c1-24-17-4-2-3-16(13-17)23-7-5-22(6-8-23)14-15-11-18(21)20-19(12-15)25-9-10-26-20/h2-4,11-13H,5-10,14H2,1H3/p+1