2-(3-oxidanylidene-7-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: 2-(3-oxidanylidene-7-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: 2-(3-oxo-7-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)acetic acid CAS Name: 2-[3-oxo-7-(1-pyrrolidinylsulfonyl)-1,4-benzoxazin-4-yl]acetic acid IUPAC Name: 2-(3-oxo-7-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)acetic acid Traditional Name: 2-(3-keto-7-pyrrolidinosulfonyl-1,4-benzoxazin-4-yl)acetic acid Formula: C14H16N2O6S MolecularWeight: 340.35164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CO3)CC(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CO3)CC(=O)O

InChI

InChI=1S/C14H16N2O6S/c17-13-9-22-12-7-10(23(20,21)15-5-1-2-6-15)3-4-11(12)16(13)8-14(18)19/h3-4,7H,1-2,5-6,8-9H2,(H,18,19)