[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] (3R)-3-(aminocarbonylamino)-3-(3-phenoxyphenyl)propanoate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] (3R)-3-(aminocarbonylamino)-3-(3-phenoxyphenyl)propanoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] (3R)-3-(3-phenoxyphenyl)-3-ureido-propanoate CAS Name: (3R)-3-(carbamoylamino)-3-(3-phenoxyphenyl)propanoic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] (3R)-3-(carbamoylamino)-3-(3-phenoxyphenyl)propanoate Traditional Name: (3R)-3-(3-phenoxyphenyl)-3-ureido-propionic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)CC(C1=CC(=CC=C1)OC2=CC=CC=C2)NC(=O)N

Isomeric SMILES

CC(C)CNC(=O)COC(=O)C[C@H](C1=CC(=CC=C1)OC2=CC=CC=C2)NC(=O)N

InChI

InChI=1S/C22H27N3O5/c1-15(2)13-24-20(26)14-29-21(27)12-19(25-22(23)28)16-7-6-10-18(11-16)30-17-8-4-3-5-9-17/h3-11,15,19H,12-14H2,1-2H3,(H,24,26)(H3,23,25,28)/t19-/m1/s1