5-fluoranyl-3-[[methyl(methylsulfonyl)amino]methyl]-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid

Systemtic Name: 5-fluoranyl-3-[[methyl(methylsulfonyl)amino]methyl]-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid Openeye Name: 5-fluoro-3-[[methyl(methylsulfonyl)amino]methyl]-1-(1-naphthylmethyl)indole-2-carboxylic acid CAS Name: 5-fluoro-3-[[methyl(methylsulfonyl)amino]methyl]-1-(1-naphthalenylmethyl)-2-indolecarboxylic acid IUPAC Name: 5-fluoro-3-[[methyl(methylsulfonyl)amino]methyl]-1-(naphthalen-1-ylmethyl)indole-2-carboxylic acid Traditional Name: 5-fluoro-3-[[mesyl(methyl)amino]methyl]-1-(1-naphthylmethyl)indole-2-carboxylic acid Formula: C23H21FN2O4S MolecularWeight: 440.487243

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=CC4=CC=CC=C43)C(=O)O)S(=O)(=O)C

Isomeric SMILES

CN(CC1=C(N(C2=C1C=C(C=C2)F)CC3=CC=CC4=CC=CC=C43)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C23H21FN2O4S/c1-25(31(2,29)30)14-20-19-12-17(24)10-11-21(19)26(22(20)23(27)28)13-16-8-5-7-15-6-3-4-9-18(15)16/h3-12H,13-14H2,1-2H3,(H,27,28)