8-[[4-[(1S)-1-(4-methoxyphenyl)ethyl]piperazin-1-ium-1-yl]methyl]-7-oxidanyl-3-phenyl-chromen-4-one

Systemtic Name: 8-[[4-[(1S)-1-(4-methoxyphenyl)ethyl]piperazin-1-ium-1-yl]methyl]-7-oxidanyl-3-phenyl-chromen-4-one Openeye Name: 7-hydroxy-8-[[4-[(1S)-1-(4-methoxyphenyl)ethyl]piperazin-1-ium-1-yl]methyl]-3-phenyl-chromen-4-one CAS Name: 7-hydroxy-8-[[4-[(1S)-1-(4-methoxyphenyl)ethyl]-1-piperazin-1-iumyl]methyl]-3-phenyl-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-[[4-[(1S)-1-(4-methoxyphenyl)ethyl]piperazin-1-ium-1-yl]methyl]-3-phenylchromen-4-one Traditional Name: 7-hydroxy-8-[[4-[(1S)-1-(4-methoxyphenyl)ethyl]piperazin-1-ium-1-yl]methyl]-3-phenyl-chromone Formula: C29H31N2O4+ MolecularWeight: 471.56744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)N2CC[NH+](CC2)CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=CC=C5)O

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC)N2CC[NH+](CC2)CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=CC=C5)O

InChI

InChI=1S/C29H30N2O4/c1-20(21-8-10-23(34-2)11-9-21)31-16-14-30(15-17-31)18-25-27(32)13-12-24-28(33)26(19-35-29(24)25)22-6-4-3-5-7-22/h3-13,19-20,32H,14-18H2,1-2H3/p+1/t20-/m0/s1