1-(3-chloranylpropyl)-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium

Systemtic Name: 1-(3-chloranylpropyl)-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium Openeye Name: 1-(3-chloropropyl)-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium CAS Name: 1-(3-chloropropyl)-3-phenyl-5,6,7,8-tetrahydro-2-benzopyran-2-ium IUPAC Name: 1-(3-chloropropyl)-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium Traditional Name: 1-(3-chloropropyl)-3-phenyl-5,6,7,8-tetrahydroisochromen-2-ium Formula: C18H20ClO+ MolecularWeight: 287.8038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C([O+]=C(C=C2C1)C3=CC=CC=C3)CCCCl

Isomeric SMILES

C1CCC2=C([O+]=C(C=C2C1)C3=CC=CC=C3)CCCCl

InChI

InChI=1S/C18H20ClO/c19-12-6-11-17-16-10-5-4-9-15(16)13-18(20-17)14-7-2-1-3-8-14/h1-3,7-8,13H,4-6,9-12H2/q+1