3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one

Systemtic Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one Openeye Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one CAS Name: 3-[[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]chromen-4-one Traditional Name: 3-[(4-o-phenetylpiperazin-1-ium-1-yl)methyl]chromone Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H24N2O3/c1-2-26-21-10-6-4-8-19(21)24-13-11-23(12-14-24)15-17-16-27-20-9-5-3-7-18(20)22(17)25/h3-10,16H,2,11-15H2,1H3/p+1