6-chloranyl-4-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-2-one dichloride

Systemtic Name: 6-chloranyl-4-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-2-one dichloride Openeye Name: 6-chloro-7-hydroxy-4-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-2-one dichloride CAS Name: 6-chloro-7-hydroxy-4-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1-benzopyran-2-one dichloride IUPAC Name: 6-chloro-7-hydroxy-4-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-2-one dichloride Traditional Name: 6-chloro-7-hydroxy-4-[(4-methylpiperazine-1,4-diium-1-yl)methyl]coumarin dichloride Formula: C15H19Cl3N2O3 MolecularWeight: 381.68196

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O.[Cl-].[Cl-]

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O.[Cl-].[Cl-]

InChI

InChI=1S/C15H17ClN2O3.2ClH/c1-17-2-4-18(5-3-17)9-10-6-15(20)21-14-8-13(19)12(16)7-11(10)14;;/h6-8,19H,2-5,9H2,1H3;2*1H