3-[[(2R)-6-chloranyl-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]benzoate

Systemtic Name: 3-[[(2R)-6-chloranyl-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: 3-[[(2R)-6-chloro-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 3-[[(2R)-6-chloro-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate IUPAC Name: 3-[[(2R)-6-chloro-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 3-[[(2R)-6-chloro-2-ethyl-3-keto-1,4-benzoxazin-4-yl]methyl]benzoate Formula: C18H15ClNO4- MolecularWeight: 344.769

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H16ClNO4/c1-2-15-17(21)20(14-9-13(19)6-7-16(14)24-15)10-11-4-3-5-12(8-11)18(22)23/h3-9,15H,2,10H2,1H3,(H,22,23)/p-1/t15-/m1/s1