ethyl 2-[6-(4-ethylpiperazin-1-yl)sulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-(4-ethylpiperazin-1-yl)sulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-(4-ethylpiperazin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate CAS Name: 2-[6-[(4-ethyl-1-piperazinyl)sulfonyl]-2-oxo-1,3-benzoxazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-(4-ethylpiperazin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate Traditional Name: 2-[6-(4-ethylpiperazino)sulfonyl-2-keto-1,3-benzoxazol-3-yl]acetic acid ethyl ester Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)OCC

InChI

InChI=1S/C17H23N3O6S/c1-3-18-7-9-19(10-8-18)27(23,24)13-5-6-14-15(11-13)26-17(22)20(14)12-16(21)25-4-2/h5-6,11H,3-4,7-10,12H2,1-2H3