[(2S)-1-[bis(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: [(2S)-1-[bis(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 5-azanyl-3-methyl-1,2-oxazole-4-carboxylate Openeye Name: [(1S)-2-(dibenzylamino)-1-methyl-2-oxo-ethyl] 5-amino-3-methyl-isoxazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isoxazolecarboxylic acid [(2S)-1-[bis(phenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(dibenzylamino)-1-oxopropan-2-yl] 5-amino-3-methyl-1,2-oxazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isoxazole-4-carboxylic acid [(1S)-2-(dibenzylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OC(C)C(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=NOC(=C1C(=O)O[C@@H](C)C(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)N

InChI

InChI=1S/C22H23N3O4/c1-15-19(20(23)29-24-15)22(27)28-16(2)21(26)25(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18/h3-12,16H,13-14,23H2,1-2H3/t16-/m0/s1