3-[4-[[(2R)-2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]propanoate

Systemtic Name: 3-[4-[[(2R)-2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]propanoate Openeye Name: 3-[4-[[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]propanoate CAS Name: 3-[4-[[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]propanoate IUPAC Name: 3-[4-[[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]propanoate Traditional Name: 3-[4-[[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]sulfonyl]phenyl]propionate Formula: C18H17N2O6S- MolecularWeight: 389.40238

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)CCC(=O)[O-])C(=O)N

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)CCC(=O)[O-])C(=O)N

InChI

InChI=1S/C18H18N2O6S/c19-18(23)16-11-20(14-3-1-2-4-15(14)26-16)27(24,25)13-8-5-12(6-9-13)7-10-17(21)22/h1-6,8-9,16H,7,10-11H2,(H2,19,23)(H,21,22)/p-1/t16-/m1/s1