ethyl 3-[2-(3,5-dimethylpiperidin-1-yl)ethanoylamino]-5-fluoranyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-(3,5-dimethylpiperidin-1-yl)ethanoylamino]-5-fluoranyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-(3,5-dimethyl-1-piperidyl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate CAS Name: 3-[[2-(3,5-dimethyl-1-piperidinyl)-1-oxoethyl]amino]-5-fluoro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3,5-dimethylpiperidin-1-yl)acetyl]amino]-5-fluoro-1H-indole-2-carboxylate Traditional Name: 3-[[2-(3,5-dimethylpiperidino)acetyl]amino]-5-fluoro-1H-indole-2-carboxylic acid ethyl ester Formula: C20H26FN3O3 MolecularWeight: 375.437143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CN3CC(CC(C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NC(=O)CN3CC(CC(C3)C)C

InChI

InChI=1S/C20H26FN3O3/c1-4-27-20(26)19-18(15-8-14(21)5-6-16(15)22-19)23-17(25)11-24-9-12(2)7-13(3)10-24/h5-6,8,12-13,22H,4,7,9-11H2,1-3H3,(H,23,25)