ethyl 5-[4-[2-(1,2-benzoxazol-3-yl)ethanoyl]piperazin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-[2-(1,2-benzoxazol-3-yl)ethanoyl]piperazin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[4-[2-(1,2-benzoxazol-3-yl)acetyl]piperazin-1-yl]sulfonylfuran-2-carboxylate CAS Name: 5-[[4-[2-(1,2-benzoxazol-3-yl)-1-oxoethyl]-1-piperazinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[2-(1,2-benzoxazol-3-yl)acetyl]piperazin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-(2-indoxazen-3-ylacetyl)piperazino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C20H21N3O7S MolecularWeight: 447.46164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=NOC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=NOC4=CC=CC=C43

InChI

InChI=1S/C20H21N3O7S/c1-2-28-20(25)17-7-8-19(29-17)31(26,27)23-11-9-22(10-12-23)18(24)13-15-14-5-3-4-6-16(14)30-21-15/h3-8H,2,9-13H2,1H3