07G

2-(tert-butylamino)-1-(2-carboxy-6-chloro-1H-indol-3-yl)-1-[(3,4-difluorobenzyl)(formyl)amino]-2-oxoethylium


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Chemical Component Summary

Name2-(tert-butylamino)-1-(2-carboxy-6-chloro-1H-indol-3-yl)-1-[(3,4-difluorobenzyl)(formyl)amino]-2-oxoethylium
Identifiers3-[1-[[3,4-bis(fluoranyl)phenyl]methyl-methanoyl-amino]-2-(tert-butylamino)-2-oxidanylidene-ethyl]-6-chloranyl-1H-indole-2-carboxylic acid
FormulaC23 H21 Cl F2 N3 O4
Molecular Weight476.88
TypeNON-POLYMER
Isomeric SMILESCC(C)(C)NC(=O)[C+](c1c2ccc(cc2[nH]c1C(=O)O)Cl)N(Cc3ccc(c(c3)F)F)C=O
InChIInChI=1S/C23H20ClF2N3O4/c1-23(2,3)28-21(31)20(29(11-30)10-12-4-7-15(25)16(26)8-12)18-14-6-5-13(24)9-17(14)27-19(18)22(32)33/h4-9,11,27H,10H2,1-3H3,(H-,28,31,32,33)/p+1
InChIKeySKZKZBKXJCIIQD-UHFFFAOYSA-O

Chemical Details

Formal Charge1
Atom Count54
Chiral Atom Count0
Bond Count56
Aromatic Bond Count16