3-(3-azanylpropyl)-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile

Systemtic Name: 3-(3-azanylpropyl)-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile Openeye Name: 3-(3-aminopropyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile CAS Name: 3-(3-aminopropyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile IUPAC Name: 3-(3-aminopropyl)-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile Traditional Name: 3-(3-aminopropyl)-1-(4-fluorophenyl)phthalan-5-carbonitrile Formula: C18H17FN2O MolecularWeight: 296.338783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C3=C(C=C(C=C3)C#N)C(O2)CCCN)F

Isomeric SMILES

C1=CC(=CC=C1C2C3=C(C=C(C=C3)C#N)C(O2)CCCN)F

InChI

InChI=1S/C18H17FN2O/c19-14-6-4-13(5-7-14)18-15-8-3-12(11-21)10-16(15)17(22-18)2-1-9-20/h3-8,10,17-18H,1-2,9,20H2