2-[1-[(3-ethyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[(3-ethyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[(3-ethyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[(3-ethyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[(3-ethyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[(3-ethyl-2-keto-1,3-benzoxazol-6-yl)sulfonyl]-4-piperidyl]acetic acid Formula: C16H20N2O6S MolecularWeight: 368.4048

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)CC(=O)O)OC1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)CC(=O)O)OC1=O

InChI

InChI=1S/C16H20N2O6S/c1-2-18-13-4-3-12(10-14(13)24-16(18)21)25(22,23)17-7-5-11(6-8-17)9-15(19)20/h3-4,10-11H,2,5-9H2,1H3,(H,19,20)