5-butanoyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-phenyl-5H-1,3-oxazole-4-carboxylic acid

Systemtic Name: 5-butanoyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-phenyl-5H-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-5-butanoyl-4-phenyl-5H-oxazole-4-carboxylic acid CAS Name: 2-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-5-(1-oxobutyl)-4-phenyl-5H-oxazole-4-carboxylic acid IUPAC Name: 5-butanoyl-2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-phenyl-5H-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-5-butyryl-4-phenyl-2-oxazoline-4-carboxylic acid Formula: C28H33N3O7 MolecularWeight: 523.57752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(N=C(O1)NC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(=O)C1C(N=C(O1)NC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C28H33N3O7/c1-4-11-22(32)23-28(25(34)35,20-14-9-6-10-15-20)31-26(38-23)30-24(33)21(16-18(2)3)29-27(36)37-17-19-12-7-5-8-13-19/h5-10,12-15,18,21,23H,4,11,16-17H2,1-3H3,(H,29,36)(H,34,35)(H,30,31,33)