3-[4-(4-fluorophenyl)-3,4-dihydro-1H-isochromen-1-yl]-N-(phenylmethyl)propan-1-amine

Systemtic Name: 3-[4-(4-fluorophenyl)-3,4-dihydro-1H-isochromen-1-yl]-N-(phenylmethyl)propan-1-amine Openeye Name: N-benzyl-3-[4-(4-fluorophenyl)isochroman-1-yl]propan-1-amine CAS Name: 3-[4-(4-fluorophenyl)-3,4-dihydro-1H-2-benzopyran-1-yl]-N-(phenylmethyl)-1-propanamine IUPAC Name: N-benzyl-3-[4-(4-fluorophenyl)-3,4-dihydro-1H-isochromen-1-yl]propan-1-amine Traditional Name: benzyl-[3-[4-(4-fluorophenyl)isochroman-1-yl]propyl]amine Formula: C25H26FNO MolecularWeight: 375.478443

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2C(O1)CCCNCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(C2=CC=CC=C2C(O1)CCCNCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FNO/c26-21-14-12-20(13-15-21)24-18-28-25(23-10-5-4-9-22(23)24)11-6-16-27-17-19-7-2-1-3-8-19/h1-5,7-10,12-15,24-25,27H,6,11,16-18H2