ethyl 4-[[3-[2-(2-methylphenoxy)ethyl]-2-oxidanylidene-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3-[2-(2-methylphenoxy)ethyl]-2-oxidanylidene-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3-[2-(2-methylphenoxy)ethyl]-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[2-(2-methylphenoxy)ethyl]-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-[2-(2-methylphenoxy)ethyl]-2-oxo-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carboxylate Traditional Name: 4-[[2-keto-3-[2-(2-methylphenoxy)ethyl]-1,3-benzoxazol-6-yl]sulfonyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCOC4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCOC4=CC=CC=C4C

InChI

InChI=1S/C23H27N3O7S/c1-3-31-22(27)24-10-12-25(13-11-24)34(29,30)18-8-9-19-21(16-18)33-23(28)26(19)14-15-32-20-7-5-4-6-17(20)2/h4-9,16H,3,10-15H2,1-2H3