3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)benzoate Formula: C16H14NO4- MolecularWeight: 284.28666

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C16H15NO4/c18-16(19)12-2-1-3-13(9-12)17-10-11-4-5-14-15(8-11)21-7-6-20-14/h1-5,8-9,17H,6-7,10H2,(H,18,19)/p-1