[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-(3-fluoro-4-methyl-anilino)-2-oxo-ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-(3-fluoro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoro-4-methylanilino)-2-oxoethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-(3-fluoro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C21H21FN2O3 MolecularWeight: 368.401443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCCC2=CNC3=CC=CC=C32)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCCC2=CNC3=CC=CC=C32)F

InChI

InChI=1S/C21H21FN2O3/c1-14-9-10-16(11-18(14)22)24-20(25)13-27-21(26)8-4-5-15-12-23-19-7-3-2-6-17(15)19/h2-3,6-7,9-12,23H,4-5,8,13H2,1H3,(H,24,25)