1-ethyl-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium

Systemtic Name: 1-ethyl-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium Openeye Name: 1-ethyl-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium CAS Name: 1-ethyl-3-phenyl-5,6,7,8-tetrahydro-2-benzopyran-2-ium IUPAC Name: 1-ethyl-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium Traditional Name: 1-ethyl-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium Formula: C17H19O+ MolecularWeight: 239.33216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2CCCCC2=CC(=[O+]1)C3=CC=CC=C3

Isomeric SMILES

CCC1=C2CCCCC2=CC(=[O+]1)C3=CC=CC=C3

InChI

InChI=1S/C17H19O/c1-2-16-15-11-7-6-10-14(15)12-17(18-16)13-8-4-3-5-9-13/h3-5,8-9,12H,2,6-7,10-11H2,1H3/q+1