1-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]benzo[f]chromen-3-one

Systemtic Name: 1-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]benzo[f]chromen-3-one Openeye Name: 1-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]benzo[f]chromen-3-one CAS Name: 1-[[4-(2-chlorophenyl)-1-piperazin-1-iumyl]methyl]-3-benzo[f][1]benzopyranone IUPAC Name: 1-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]benzo[f]chromen-3-one Traditional Name: 1-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]benzo[f]chromen-3-one Formula: C24H22ClN2O2+ MolecularWeight: 405.89668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C5=CC=CC=C5Cl

InChI

InChI=1S/C24H21ClN2O2/c25-20-7-3-4-8-21(20)27-13-11-26(12-14-27)16-18-15-23(28)29-22-10-9-17-5-1-2-6-19(17)24(18)22/h1-10,15H,11-14,16H2/p+1