[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-fluoranyl-phenyl]methanamine

Systemtic Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-fluoranyl-phenyl]methanamine Openeye Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-fluoro-phenyl]methanamine CAS Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-fluorophenyl]methanamine IUPAC Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-fluorophenyl]methanamine Traditional Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-4-fluoro-benzyl]amine Formula: C16H17FN2O2S MolecularWeight: 320.381783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)CN)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)CN)F

InChI

InChI=1S/C16H17FN2O2S/c17-15-6-5-12(10-18)9-16(15)22(20,21)19-8-7-13-3-1-2-4-14(13)11-19/h1-6,9H,7-8,10-11,18H2