2-[6-chloranyl-2-(3-ethoxy-4-ethyl-pyridin-2-yl)carbonyl-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-2-(3-ethoxy-4-ethyl-pyridin-2-yl)carbonyl-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[6-chloro-2-(3-ethoxy-4-ethyl-pyridine-2-carbonyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[6-chloro-2-[(3-ethoxy-4-ethyl-2-pyridinyl)-oxomethyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[6-chloro-2-(3-ethoxy-4-ethylpyridine-2-carbonyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[6-chloro-2-(3-ethoxy-4-ethyl-picolinoyl)-1H-indol-3-yl]acetic acid Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=C1)C(=O)C2=C(C3=C(N2)C=C(C=C3)Cl)CC(=O)O)OCC

Isomeric SMILES

CCC1=C(C(=NC=C1)C(=O)C2=C(C3=C(N2)C=C(C=C3)Cl)CC(=O)O)OCC

InChI

InChI=1S/C20H19ClN2O4/c1-3-11-7-8-22-18(20(11)27-4-2)19(26)17-14(10-16(24)25)13-6-5-12(21)9-15(13)23-17/h5-9,23H,3-4,10H2,1-2H3,(H,24,25)