[(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-butan-2-yl] 4-(phenoxymethyl)benzoate

Systemtic Name: [(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-butan-2-yl] 4-(phenoxymethyl)benzoate Openeye Name: [(1S)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] 4-(phenoxymethyl)benzoate CAS Name: 4-(phenoxymethyl)benzoic acid [(2S)-1-[(5-methyl-3-isoxazolyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxobutan-2-yl] 4-(phenoxymethyl)benzoate Traditional Name: 4-(phenoxymethyl)benzoic acid [(1S)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)OC(=O)C2=CC=C(C=C2)COC3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)NC1=NOC(=C1)C)OC(=O)C2=CC=C(C=C2)COC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5/c1-3-19(21(25)23-20-13-15(2)29-24-20)28-22(26)17-11-9-16(10-12-17)14-27-18-7-5-4-6-8-18/h4-13,19H,3,14H2,1-2H3,(H,23,24,25)/t19-/m0/s1