dibutyl-[[3-(4-chlorophenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]azanium

Systemtic Name: dibutyl-[[3-(4-chlorophenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]azanium Openeye Name: dibutyl-[[3-(4-chlorophenyl)-7-hydroxy-4-oxo-chromen-8-yl]methyl]ammonium CAS Name: dibutyl-[[3-(4-chlorophenyl)-7-hydroxy-4-oxo-1-benzopyran-8-yl]methyl]ammonium IUPAC Name: dibutyl-[[3-(4-chlorophenyl)-7-hydroxy-4-oxochromen-8-yl]methyl]azanium Traditional Name: dibutyl-[[3-(4-chlorophenyl)-7-hydroxy-4-keto-chromen-8-yl]methyl]ammonium Formula: C24H29ClNO3+ MolecularWeight: 414.94496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C24H28ClNO3/c1-3-5-13-26(14-6-4-2)15-20-22(27)12-11-19-23(28)21(16-29-24(19)20)17-7-9-18(25)10-8-17/h7-12,16,27H,3-6,13-15H2,1-2H3/p+1