N-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]-1-(7-nitro-3,4-dihydro-2H-chromen-2-yl)methanamine

Systemtic Name: N-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]-1-(7-nitro-3,4-dihydro-2H-chromen-2-yl)methanamine Openeye Name: N-[[5-(4-fluorophenyl)-3-pyridyl]methyl]-1-(7-nitrochroman-2-yl)methanamine CAS Name: N-[[5-(4-fluorophenyl)-3-pyridinyl]methyl]-1-(7-nitro-3,4-dihydro-2H-1-benzopyran-2-yl)methanamine IUPAC Name: N-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]-1-(7-nitro-3,4-dihydro-2H-chromen-2-yl)methanamine Traditional Name: [5-(4-fluorophenyl)-3-pyridyl]methyl-[(7-nitrochroman-2-yl)methyl]amine Formula: C22H20FN3O3 MolecularWeight: 393.410903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)[N+](=O)[O-])OC1CNCC3=CN=CC(=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC2=C(C=C(C=C2)[N+](=O)[O-])OC1CNCC3=CN=CC(=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20FN3O3/c23-19-5-1-16(2-6-19)18-9-15(11-24-13-18)12-25-14-21-8-4-17-3-7-20(26(27)28)10-22(17)29-21/h1-3,5-7,9-11,13,21,25H,4,8,12,14H2