3-[2-methyl-1-(phenylmethoxycarbonylamino)propyl]-5-(phenoxymethyl)-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-[2-methyl-1-(phenylmethoxycarbonylamino)propyl]-5-(phenoxymethyl)-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 3-[1-(benzyloxycarbonylamino)-2-methyl-propyl]-5-(phenoxymethyl)-4H-isoxazole-5-carboxylic acid CAS Name: 3-[2-methyl-1-(phenylmethoxycarbonylamino)propyl]-5-(phenoxymethyl)-4H-isoxazole-5-carboxylic acid IUPAC Name: 3-[2-methyl-1-(phenylmethoxycarbonylamino)propyl]-5-(phenoxymethyl)-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 3-[1-(benzyloxycarbonylamino)-2-methyl-propyl]-5-(phenoxymethyl)-2-isoxazoline-5-carboxylic acid Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NOC(C1)(COC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C1=NOC(C1)(COC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O6/c1-16(2)20(24-22(28)29-14-17-9-5-3-6-10-17)19-13-23(21(26)27,31-25-19)15-30-18-11-7-4-8-12-18/h3-12,16,20H,13-15H2,1-2H3,(H,24,28)(H,26,27)