1-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzo[f]chromen-3-one

Systemtic Name: 1-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzo[f]chromen-3-one Openeye Name: 1-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzo[f]chromen-3-one CAS Name: 1-[[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]methyl]-3-benzo[f][1]benzopyranone IUPAC Name: 1-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzo[f]chromen-3-one Traditional Name: 1-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzo[f]chromen-3-one Formula: C20H24N2O3+2 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCO)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1CCO)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H22N2O3/c23-12-11-21-7-9-22(10-8-21)14-16-13-19(24)25-18-6-5-15-3-1-2-4-17(15)20(16)18/h1-6,13,23H,7-12,14H2/p+2