[3-(azepan-1-ylsulfonyl)-4-fluoranyl-phenyl]methanamine

Systemtic Name: [3-(azepan-1-ylsulfonyl)-4-fluoranyl-phenyl]methanamine Openeye Name: [3-(azepan-1-ylsulfonyl)-4-fluoro-phenyl]methanamine CAS Name: [3-(1-azepanylsulfonyl)-4-fluorophenyl]methanamine IUPAC Name: [3-(azepan-1-ylsulfonyl)-4-fluorophenyl]methanamine Traditional Name: [3-(azepan-1-ylsulfonyl)-4-fluoro-benzyl]amine Formula: C13H19FN2O2S MolecularWeight: 286.365563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)CN)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)CN)F

InChI

InChI=1S/C13H19FN2O2S/c14-12-6-5-11(10-15)9-13(12)19(17,18)16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8,10,15H2