6-oxidanyl-4-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]chromen-2-one

Systemtic Name: 6-oxidanyl-4-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]chromen-2-one Openeye Name: 4-[(4-cinnamylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-chromen-2-one CAS Name: 6-hydroxy-4-[[4-(3-phenylprop-2-enyl)-1-piperazine-1,4-diiumyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-hydroxy-4-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]chromen-2-one Traditional Name: 4-[(4-cinnamylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-coumarin Formula: C23H26N2O3+2 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC=CC2=CC=CC=C2)CC3=CC(=O)OC4=C3C=C(C=C4)O

Isomeric SMILES

C1C[NH+](CC[NH+]1CC=CC2=CC=CC=C2)CC3=CC(=O)OC4=C3C=C(C=C4)O

InChI

InChI=1S/C23H24N2O3/c26-20-8-9-22-21(16-20)19(15-23(27)28-22)17-25-13-11-24(12-14-25)10-4-7-18-5-2-1-3-6-18/h1-9,15-16,26H,10-14,17H2/p+2