diethyl-[4-(9-oxidanylxanthen-9-yl)but-2-ynyl]azanium

Systemtic Name: diethyl-[4-(9-oxidanylxanthen-9-yl)but-2-ynyl]azanium Openeye Name: diethyl-[4-(9-hydroxyxanthen-9-yl)but-2-ynyl]ammonium CAS Name: diethyl-[4-(9-hydroxy-9-xanthenyl)but-2-ynyl]ammonium IUPAC Name: diethyl-[4-(9-hydroxyxanthen-9-yl)but-2-ynyl]azanium Traditional Name: diethyl-[4-(9-hydroxyxanthen-9-yl)but-2-ynyl]ammonium Formula: C21H24NO2+ MolecularWeight: 322.42076

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC#CCC1(C2=CC=CC=C2OC3=CC=CC=C31)O

Isomeric SMILES

CC[NH+](CC)CC#CCC1(C2=CC=CC=C2OC3=CC=CC=C31)O

InChI

InChI=1S/C21H23NO2/c1-3-22(4-2)16-10-9-15-21(23)17-11-5-7-13-19(17)24-20-14-8-6-12-18(20)21/h5-8,11-14,23H,3-4,15-16H2,1-2H3/p+1