methyl 3-[[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-(1,2-oxazol-5-ylcarbonyl)amino]benzoate

Systemtic Name: methyl 3-[[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-(1,2-oxazol-5-ylcarbonyl)amino]benzoate Openeye Name: methyl 3-[[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]-(isoxazole-5-carbonyl)amino]benzoate CAS Name: 3-[[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-[5-isoxazolyl(oxo)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-(1,2-oxazole-5-carbonyl)amino]benzoate Traditional Name: 3-[[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]-(isoxazole-5-carbonyl)amino]benzoic acid methyl ester Formula: C26H27N3O5 MolecularWeight: 461.50968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N(C(C2=CC=CC=C2)C(=O)NC3CCCCC3)C(=O)C4=CC=NO4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N(C(C2=CC=CC=C2)C(=O)NC3CCCCC3)C(=O)C4=CC=NO4

InChI

InChI=1S/C26H27N3O5/c1-33-26(32)19-11-8-14-21(17-19)29(25(31)22-15-16-27-34-22)23(18-9-4-2-5-10-18)24(30)28-20-12-6-3-7-13-20/h2,4-5,8-11,14-17,20,23H,3,6-7,12-13H2,1H3,(H,28,30)