2-[1-[(E)-2-(dimethylamino)ethenyl]-2-ethoxycarbonyl-3-ethyl-5-fluoranyl-2H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(E)-2-(dimethylamino)ethenyl]-2-ethoxycarbonyl-3-ethyl-5-fluoranyl-2H-indol-3-yl]ethanoic acid Openeye Name: 2-[1-[(E)-2-(dimethylamino)vinyl]-2-ethoxycarbonyl-3-ethyl-5-fluoro-indolin-3-yl]acetic acid CAS Name: 2-[1-[(E)-2-(dimethylamino)ethenyl]-2-ethoxycarbonyl-3-ethyl-5-fluoro-2H-indol-3-yl]acetic acid IUPAC Name: 2-[1-[(E)-2-(dimethylamino)ethenyl]-2-ethoxycarbonyl-3-ethyl-5-fluoro-2H-indol-3-yl]acetic acid Traditional Name: 2-[2-carbethoxy-1-[(E)-2-(dimethylamino)vinyl]-3-ethyl-5-fluoro-indolin-3-yl]acetic acid Formula: C19H25FN2O4 MolecularWeight: 364.411203

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C2=C1C=C(C=C2)F)C=CN(C)C)C(=O)OCC)CC(=O)O

Isomeric SMILES

CCC1(C(N(C2=C1C=C(C=C2)F)/C=C/N(C)C)C(=O)OCC)CC(=O)O

InChI

InChI=1S/C19H25FN2O4/c1-5-19(12-16(23)24)14-11-13(20)7-8-15(14)22(10-9-21(3)4)17(19)18(25)26-6-2/h7-11,17H,5-6,12H2,1-4H3,(H,23,24)/b10-9+