[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C21H23NO4/c1-13(2)11-22-21(24)14(3)26-19(23)10-16-12-25-18-9-8-15-6-4-5-7-17(15)20(16)18/h4-9,12-14H,10-11H2,1-3H3,(H,22,24)/t14-/m0/s1