ethyl 4-[3-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]propanoylamino]benzoate

Systemtic Name: ethyl 4-[3-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]propanoylamino]benzoate Openeye Name: ethyl 4-[3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanoylamino]benzoate CAS Name: 4-[[3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanoylamino]benzoate Traditional Name: 4-[3-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]propanoylamino]benzoic acid ethyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C

InChI

InChI=1S/C20H20N2O7S/c1-3-28-19(24)13-4-6-14(7-5-13)21-18(23)10-11-30(26,27)15-8-9-16-17(12-15)29-20(25)22(16)2/h4-9,12H,3,10-11H2,1-2H3,(H,21,23)