methyl 4-[[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]methyl]benzoate Openeye Name: methyl 4-[[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]methyl]benzoate CAS Name: 4-[[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]methyl]benzoate Traditional Name: 4-[[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]methyl]benzoic acid methyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C20H20N2O5/c1-26-19(24)15-10-8-14(9-11-15)13-21-18(23)7-4-12-22-16-5-2-3-6-17(16)27-20(22)25/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,21,23)