ethyl 5-fluoranyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-fluoranyl-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate Openeye Name: ethyl 5-fluoro-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate CAS Name: 5-fluoro-3-[(1-oxo-2-phenylbutyl)amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-fluoro-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylate Traditional Name: 5-fluoro-3-(2-phenylbutanoylamino)-1H-indole-2-carboxylic acid ethyl ester Formula: C21H21FN2O3 MolecularWeight: 368.401443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=C2C=C(C=C3)F)C(=O)OCC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=C(NC3=C2C=C(C=C3)F)C(=O)OCC

InChI

InChI=1S/C21H21FN2O3/c1-3-15(13-8-6-5-7-9-13)20(25)24-18-16-12-14(22)10-11-17(16)23-19(18)21(26)27-4-2/h5-12,15,23H,3-4H2,1-2H3,(H,24,25)