4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate

Systemtic Name: 4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate Openeye Name: 4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate CAS Name: 4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate IUPAC Name: 4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate Traditional Name: 4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC[NH+](C2)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)OC[NH+](C2)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H15NO4/c1-20-14-6-7-15-12(8-14)9-17(10-21-15)13-4-2-11(3-5-13)16(18)19/h2-8H,9-10H2,1H3,(H,18,19)