2-[(2R)-6-ethylsulfonyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2R)-6-ethylsulfonyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-6-ethylsulfonyl-4-isopropyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2R)-6-ethylsulfonyl-3-oxo-4-propan-2-yl-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2R)-6-ethylsulfonyl-3-oxo-4-propan-2-yl-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2R)-6-esyl-4-isopropyl-3-keto-1,4-benzoxazin-2-yl]acetic acid Formula: C15H19NO6S MolecularWeight: 341.37946

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(C(=O)N2C(C)C)CC(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2C(C)C)CC(=O)O

InChI

InChI=1S/C15H19NO6S/c1-4-23(20,21)10-5-6-12-11(7-10)16(9(2)3)15(19)13(22-12)8-14(17)18/h5-7,9,13H,4,8H2,1-3H3,(H,17,18)/t13-/m1/s1