2-octyl-1,2,3,4-tetrahydroxanthen-10-ium

Systemtic Name: 2-octyl-1,2,3,4-tetrahydroxanthen-10-ium Openeye Name: 2-octyl-1,2,3,4-tetrahydroxanthen-10-ium CAS Name: 2-octyl-1,2,3,4-tetrahydroxanthen-10-ium IUPAC Name: 2-octyl-1,2,3,4-tetrahydroxanthen-10-ium Traditional Name: 2-octyl-1,2,3,4-tetrahydroxanthen-10-ium Formula: C21H29O+ MolecularWeight: 297.45436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC2=[O+]C3=CC=CC=C3C=C2C1

Isomeric SMILES

CCCCCCCCC1CCC2=[O+]C3=CC=CC=C3C=C2C1

InChI

InChI=1S/C21H29O/c1-2-3-4-5-6-7-10-17-13-14-21-19(15-17)16-18-11-8-9-12-20(18)22-21/h8-9,11-12,16-17H,2-7,10,13-15H2,1H3/q+1