2-[(2R)-6-chloranyl-3-oxidanylidene-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2R)-6-chloranyl-3-oxidanylidene-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-6-chloro-3-oxo-4-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2R)-6-chloro-3-oxo-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2R)-6-chloro-3-oxo-4-(2-oxo-2-pyrrolidin-1-ylethyl)-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2R)-6-chloro-3-keto-4-(2-keto-2-pyrrolidino-ethyl)-1,4-benzoxazin-2-yl]acetic acid Formula: C16H17ClN2O5 MolecularWeight: 352.76958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=C(C=CC(=C3)Cl)OC(C2=O)CC(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=C(C=CC(=C3)Cl)O[C@@H](C2=O)CC(=O)O

InChI

InChI=1S/C16H17ClN2O5/c17-10-3-4-12-11(7-10)19(9-14(20)18-5-1-2-6-18)16(23)13(24-12)8-15(21)22/h3-4,7,13H,1-2,5-6,8-9H2,(H,21,22)/t13-/m1/s1