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

Systemtic Name: 7-oxidanyl-3-phenyl-8-[[4-[4-(phenylmethyl)phenyl]piperazin-1-ium-1-yl]methyl]chromen-4-one Openeye Name: 8-[[4-(4-benzylphenyl)piperazin-1-ium-1-yl]methyl]-7-hydroxy-3-phenyl-chromen-4-one CAS Name: 7-hydroxy-3-phenyl-8-[[4-[4-(phenylmethyl)phenyl]-1-piperazin-1-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 8-[[4-(4-benzylphenyl)piperazin-1-ium-1-yl]methyl]-7-hydroxy-3-phenylchromen-4-one Traditional Name: 8-[[4-(4-benzylphenyl)piperazin-1-ium-1-yl]methyl]-7-hydroxy-3-phenyl-chromone Formula: C33H31N2O3+ MolecularWeight: 503.61084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O)C5=CC=C(C=C5)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O)C5=CC=C(C=C5)CC6=CC=CC=C6

InChI

InChI=1S/C33H30N2O3/c36-31-16-15-28-32(37)30(26-9-5-2-6-10-26)23-38-33(28)29(31)22-34-17-19-35(20-18-34)27-13-11-25(12-14-27)21-24-7-3-1-4-8-24/h1-16,23,36H,17-22H2/p+1