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

Systemtic Name: ethyl 3-[2-[1,3-benzodioxol-5-yl(ethyl)amino]ethanoylamino]-5-fluoranyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-fluoro-1H-indole-2-carboxylate CAS Name: 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]-1-oxoethyl]amino]-5-fluoro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-fluoro-1H-indole-2-carboxylate Traditional Name: 3-[[2-[1,3-benzodioxol-5-yl(ethyl)amino]acetyl]amino]-5-fluoro-1H-indole-2-carboxylic acid ethyl ester Formula: C22H22FN3O5 MolecularWeight: 427.425583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)OCC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC(=O)NC1=C(NC2=C1C=C(C=C2)F)C(=O)OCC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22FN3O5/c1-3-26(14-6-8-17-18(10-14)31-12-30-17)11-19(27)25-20-15-9-13(23)5-7-16(15)24-21(20)22(28)29-4-2/h5-10,24H,3-4,11-12H2,1-2H3,(H,25,27)