4-[[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]methyl]-6-propan-2-yl-chromen-2-one dichloride

Systemtic Name: 4-[[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]methyl]-6-propan-2-yl-chromen-2-one dichloride Openeye Name: 6-isopropyl-4-[[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]methyl]chromen-2-one dichloride CAS Name: 4-[[4-(2-methoxyphenyl)-1-piperazine-1,4-diiumyl]methyl]-6-propan-2-yl-1-benzopyran-2-one dichloride IUPAC Name: 4-[[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]methyl]-6-propan-2-ylchromen-2-one dichloride Traditional Name: 6-isopropyl-4-[[4-(2-methoxyphenyl)piperazine-1,4-diium-1-yl]methyl]coumarin dichloride Formula: C24H30Cl2N2O3 MolecularWeight: 465.4126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC(=O)C=C2C[NH+]3CC[NH+](CC3)C4=CC=CC=C4OC.[Cl-].[Cl-]

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC(=O)C=C2C[NH+]3CC[NH+](CC3)C4=CC=CC=C4OC.[Cl-].[Cl-]

InChI

InChI=1S/C24H28N2O3.2ClH/c1-17(2)18-8-9-22-20(14-18)19(15-24(27)29-22)16-25-10-12-26(13-11-25)21-6-4-5-7-23(21)28-3;;/h4-9,14-15,17H,10-13,16H2,1-3H3;2*1H