2-[(2R)-6-chloranyl-3-oxidanylidene-4-phenethyl-1,4-benzoxazin-2-yl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C=CC(=C3)Cl)OC(C2=O)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C=CC(=C3)Cl)O[C@@H](C2=O)CC(=O)[O-]

InChI

InChI=1S/C18H16ClNO4/c19-13-6-7-15-14(10-13)20(9-8-12-4-2-1-3-5-12)18(23)16(24-15)11-17(21)22/h1-7,10,16H,8-9,11H2,(H,21,22)/p-1/t16-/m1/s1