(4-methylcyclohexyl) 4-[2-(5-fluoranyl-2-methyl-1H-indol-3-yl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: (4-methylcyclohexyl) 4-[2-(5-fluoranyl-2-methyl-1H-indol-3-yl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: (4-methylcyclohexyl) 4-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethylamino]-4-oxobutanoic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 4-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethylamino]-4-keto-butyric acid (4-methylcyclohexyl) ester Formula: C22H29FN2O3 MolecularWeight: 388.475663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)CCC(=O)NCCC2=C(NC3=C2C=C(C=C3)F)C

Isomeric SMILES

CC1CCC(CC1)OC(=O)CCC(=O)NCCC2=C(NC3=C2C=C(C=C3)F)C

InChI

InChI=1S/C22H29FN2O3/c1-14-3-6-17(7-4-14)28-22(27)10-9-21(26)24-12-11-18-15(2)25-20-8-5-16(23)13-19(18)20/h5,8,13-14,17,25H,3-4,6-7,9-12H2,1-2H3,(H,24,26)