2-[3-acetamido-2-ethyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[3-acetamido-2-ethyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid Openeye Name: 2-(3-acetamido-1-benzyl-2-ethyl-indol-4-yl)oxyacetic acid CAS Name: 2-[[3-acetamido-2-ethyl-1-(phenylmethyl)-4-indolyl]oxy]acetic acid IUPAC Name: 2-(3-acetamido-1-benzyl-2-ethylindol-4-yl)oxyacetic acid Traditional Name: 2-(3-acetamido-1-benzyl-2-ethyl-indol-4-yl)oxyacetic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)O)NC(=O)C

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)O)NC(=O)C

InChI

InChI=1S/C21H22N2O4/c1-3-16-21(22-14(2)24)20-17(10-7-11-18(20)27-13-19(25)26)23(16)12-15-8-5-4-6-9-15/h4-11H,3,12-13H2,1-2H3,(H,22,24)(H,25,26)