3-(2-azanylethyl)-4,6-bis(fluoranyl)-5-methoxy-1H-indole-2-carboxylic acid

Systemtic Name: 3-(2-azanylethyl)-4,6-bis(fluoranyl)-5-methoxy-1H-indole-2-carboxylic acid Openeye Name: 3-(2-aminoethyl)-4,6-difluoro-5-methoxy-1H-indole-2-carboxylic acid CAS Name: 3-(2-aminoethyl)-4,6-difluoro-5-methoxy-1H-indole-2-carboxylic acid IUPAC Name: 3-(2-aminoethyl)-4,6-difluoro-5-methoxy-1H-indole-2-carboxylic acid Traditional Name: 3-(2-aminoethyl)-4,6-difluoro-5-methoxy-1H-indole-2-carboxylic acid Formula: C12H12F2N2O3 MolecularWeight: 270.232086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1F)C(=C(N2)C(=O)O)CCN)F

Isomeric SMILES

COC1=C(C=C2C(=C1F)C(=C(N2)C(=O)O)CCN)F

InChI

InChI=1S/C12H12F2N2O3/c1-19-11-6(13)4-7-8(9(11)14)5(2-3-15)10(16-7)12(17)18/h4,16H,2-3,15H2,1H3,(H,17,18)