3-[[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]-methyl-amino]-6-chloranyl-1H-indole-2-carboxylic acid

Systemtic Name: 3-[[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl]-methyl-amino]-6-chloranyl-1H-indole-2-carboxylic acid Openeye Name: 6-chloro-3-[[2-(3,4-difluorophenyl)-2-oxo-ethyl]-methyl-amino]-1H-indole-2-carboxylic acid CAS Name: 6-chloro-3-[[2-(3,4-difluorophenyl)-2-oxoethyl]-methylamino]-1H-indole-2-carboxylic acid IUPAC Name: 6-chloro-3-[[2-(3,4-difluorophenyl)-2-oxoethyl]-methylamino]-1H-indole-2-carboxylic acid Traditional Name: 6-chloro-3-[[2-(3,4-difluorophenyl)-2-keto-ethyl]-methyl-amino]-1H-indole-2-carboxylic acid Formula: C18H13ClF2N2O3 MolecularWeight: 378.757226

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)C1=CC(=C(C=C1)F)F)C2=C(NC3=C2C=CC(=C3)Cl)C(=O)O

Isomeric SMILES

CN(CC(=O)C1=CC(=C(C=C1)F)F)C2=C(NC3=C2C=CC(=C3)Cl)C(=O)O

InChI

InChI=1S/C18H13ClF2N2O3/c1-23(8-15(24)9-2-5-12(20)13(21)6-9)17-11-4-3-10(19)7-14(11)22-16(17)18(25)26/h2-7,22H,8H2,1H3,(H,25,26)