6-chloranyl-3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one

Systemtic Name: 6-chloranyl-3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one Openeye Name: 6-chloro-3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one CAS Name: 6-chloro-3-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 6-chloro-3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one Traditional Name: 6-chloro-3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]chromone Formula: C21H22ClN2O3+ MolecularWeight: 385.86398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=COC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=COC4=C(C3=O)C=C(C=C4)Cl

InChI

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