8-[[2-[4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium-1-yl]ethylamino]methyl]-3-methyl-2-phenyl-chromen-4-one

Systemtic Name: 8-[[2-[4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium-1-yl]ethylamino]methyl]-3-methyl-2-phenyl-chromen-4-one Openeye Name: 8-[[2-[4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium-1-yl]ethylamino]methyl]-3-methyl-2-phenyl-chromen-4-one CAS Name: 8-[[2-[4-(2-methoxyphenyl)-1-methyl-1-piperazin-1-iumyl]ethylamino]methyl]-3-methyl-2-phenyl-1-benzopyran-4-one IUPAC Name: 8-[[2-[4-(2-methoxyphenyl)-1-methylpiperazin-1-ium-1-yl]ethylamino]methyl]-3-methyl-2-phenylchromen-4-one Traditional Name: 8-[[2-[4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium-1-yl]ethylamino]methyl]-3-methyl-2-phenyl-chromone Formula: C31H36N3O3+ MolecularWeight: 498.63584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2CNCC[N+]3(CCN(CC3)C4=CC=CC=C4OC)C)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2CNCC[N+]3(CCN(CC3)C4=CC=CC=C4OC)C)C5=CC=CC=C5

InChI

InChI=1S/C31H36N3O3/c1-23-29(35)26-13-9-12-25(31(26)37-30(23)24-10-5-4-6-11-24)22-32-16-19-34(2)20-17-33(18-21-34)27-14-7-8-15-28(27)36-3/h4-15,32H,16-22H2,1-3H3/q+1