3-[(2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]propanoic acid

Systemtic Name: 3-[(2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]propanoic acid Openeye Name: 3-[(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]propanoic acid CAS Name: 3-[(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]propanoic acid IUPAC Name: 3-[(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]propanoic acid Traditional Name: 3-[(2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl)sulfonyl]propionic acid Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1S(=O)(=O)CCC(=O)O)C(=O)N

Isomeric SMILES

C1C(OC2=CC=CC=C2N1S(=O)(=O)CCC(=O)O)C(=O)N

InChI

InChI=1S/C12H14N2O6S/c13-12(17)10-7-14(21(18,19)6-5-11(15)16)8-3-1-2-4-9(8)20-10/h1-4,10H,5-7H2,(H2,13,17)(H,15,16)