6-chloranyl-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one dihydrochloride

Systemtic Name: 6-chloranyl-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one dihydrochloride Openeye Name: 6-chloro-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one dihydrochloride CAS Name: 6-chloro-4-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-1-benzopyran-2-one dihydrochloride IUPAC Name: 6-chloro-4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one dihydrochloride Traditional Name: 6-chloro-4-[[4-(2-methoxyphenyl)piperazino]methyl]coumarin dihydrochloride Formula: C21H23Cl3N2O3 MolecularWeight: 457.77792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC3=CC(=O)OC4=C3C=C(C=C4)Cl.Cl.Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC3=CC(=O)OC4=C3C=C(C=C4)Cl.Cl.Cl

InChI

InChI=1S/C21H21ClN2O3.2ClH/c1-26-20-5-3-2-4-18(20)24-10-8-23(9-11-24)14-15-12-21(25)27-19-7-6-16(22)13-17(15)19;;/h2-7,12-13H,8-11,14H2,1H3;2*1H