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

Systemtic Name: 3-[[(2R)-2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: 3-[[(2R)-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 3-[[(2R)-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate IUPAC Name: 3-[[(2R)-2-ethyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 3-[[(2R)-2-ethyl-3-keto-1,4-benzoxazin-4-yl]methyl]benzoate Formula: C18H16NO4- MolecularWeight: 310.32394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CC=CC=C2O1)CC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=CC=CC=C2O1)CC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C18H17NO4/c1-2-15-17(20)19(14-8-3-4-9-16(14)23-15)11-12-6-5-7-13(10-12)18(21)22/h3-10,15H,2,11H2,1H3,(H,21,22)/p-1/t15-/m1/s1