[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-(4-phenylazanylphenoxy)ethanoate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 2-(4-phenylazanylphenoxy)ethanoate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 2-(4-anilinophenoxy)acetate CAS Name: 2-(4-anilinophenoxy)acetic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 2-(4-anilinophenoxy)acetate Traditional Name: 2-(4-anilinophenoxy)acetic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)COC1=CC=C(C=C1)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)COC1=CC=C(C=C1)NC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O4/c1-15(2)13-22-21(25)16(3)27-20(24)14-26-19-11-9-18(10-12-19)23-17-7-5-4-6-8-17/h4-12,15-16,23H,13-14H2,1-3H3,(H,22,25)/t16-/m0/s1