2-[3-[4-(2-azanylethylcarbamoyl)phenoxy]-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[4-(2-azanylethylcarbamoyl)phenoxy]-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-[4-(2-aminoethylcarbamoyl)phenoxy]-5-fluoro-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-[4-[(2-aminoethylamino)-oxomethyl]phenoxy]-5-fluoro-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-[4-(2-aminoethylcarbamoyl)phenoxy]-5-fluoro-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-[4-(2-aminoethylcarbamoyl)phenoxy]-5-fluoro-2-methyl-indol-1-yl]acetic acid Formula: C20H20FN3O4 MolecularWeight: 385.388903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)OC3=CC=C(C=C3)C(=O)NCCN

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)OC3=CC=C(C=C3)C(=O)NCCN

InChI

InChI=1S/C20H20FN3O4/c1-12-19(16-10-14(21)4-7-17(16)24(12)11-18(25)26)28-15-5-2-13(3-6-15)20(27)23-9-8-22/h2-7,10H,8-9,11,22H2,1H3,(H,23,27)(H,25,26)