1-(6-chloranylhexan-3-yl)-1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromene

Systemtic Name: 1-(6-chloranylhexan-3-yl)-1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromene Openeye Name: 1-(4-chloro-1-ethyl-butyl)-1-(4-fluorophenyl)-6,7-dimethoxy-isochromane CAS Name: 1-(6-chlorohexan-3-yl)-1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran IUPAC Name: 1-(6-chlorohexan-3-yl)-1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromene Traditional Name: 1-(4-chloro-1-ethyl-butyl)-1-(4-fluorophenyl)-6,7-dimethoxy-isochroman Formula: C23H28ClFO3 MolecularWeight: 406.918023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCl)C1(C2=CC(=C(C=C2CCO1)OC)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(CCCCl)C1(C2=CC(=C(C=C2CCO1)OC)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H28ClFO3/c1-4-17(6-5-12-24)23(18-7-9-19(25)10-8-18)20-15-22(27-3)21(26-2)14-16(20)11-13-28-23/h7-10,14-15,17H,4-6,11-13H2,1-3H3