5-fluoranyl-3-(methylsulfonylaminomethyl)-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid

Systemtic Name: 5-fluoranyl-3-(methylsulfonylaminomethyl)-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid Openeye Name: 5-fluoro-3-(methanesulfonamidomethyl)-1-(1-naphthylmethyl)indole-2-carboxylic acid CAS Name: 5-fluoro-3-(methanesulfonamidomethyl)-1-(1-naphthalenylmethyl)-2-indolecarboxylic acid IUPAC Name: 5-fluoro-3-(methanesulfonamidomethyl)-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid Traditional Name: 5-fluoro-3-(methanesulfonamidomethyl)-1-(1-naphthylmethyl)indole-2-carboxylic acid Formula: C22H19FN2O4S MolecularWeight: 426.460663

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CS(=O)(=O)NCC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=CC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C22H19FN2O4S/c1-30(28,29)24-12-19-18-11-16(23)9-10-20(18)25(21(19)22(26)27)13-15-7-4-6-14-5-2-3-8-17(14)15/h2-11,24H,12-13H2,1H3,(H,26,27)