(2-phenyl-1,3-oxazol-4-yl)methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (2-phenyloxazol-4-yl)methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid (2-phenyloxazol-4-yl)methyl ester Formula: C23H23N3O6S MolecularWeight: 469.51022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=COC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=COC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O6S/c1-17(27)25-11-13-26(14-12-25)33(29,30)21-9-7-19(8-10-21)23(28)32-16-20-15-31-22(24-20)18-5-3-2-4-6-18/h2-10,15H,11-14,16H2,1H3