1-[(3S,4S)-4-(2-ethyl-6-fluoranyl-phenoxy)-3,4-dihydro-1H-isochromen-3-yl]-N-methyl-methanamine

Systemtic Name: 1-[(3S,4S)-4-(2-ethyl-6-fluoranyl-phenoxy)-3,4-dihydro-1H-isochromen-3-yl]-N-methyl-methanamine Openeye Name: 1-[(3S,4S)-4-(2-ethyl-6-fluoro-phenoxy)isochroman-3-yl]-N-methyl-methanamine CAS Name: 1-[(3S,4S)-4-(2-ethyl-6-fluorophenoxy)-3,4-dihydro-1H-2-benzopyran-3-yl]-N-methylmethanamine IUPAC Name: 1-[(3S,4S)-4-(2-ethyl-6-fluorophenoxy)-3,4-dihydro-1H-isochromen-3-yl]-N-methylmethanamine Traditional Name: [(3S,4S)-4-(2-ethyl-6-fluoro-phenoxy)isochroman-3-yl]methyl-methyl-amine Formula: C19H22FNO2 MolecularWeight: 315.381883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)F)OC2C(OCC3=CC=CC=C23)CNC

Isomeric SMILES

CCC1=C(C(=CC=C1)F)O[C@@H]2[C@@H](OCC3=CC=CC=C23)CNC

InChI

InChI=1S/C19H22FNO2/c1-3-13-8-6-10-16(20)18(13)23-19-15-9-5-4-7-14(15)12-22-17(19)11-21-2/h4-10,17,19,21H,3,11-12H2,1-2H3/t17-,19-/m0/s1