2-(1,3-benzothiazol-2-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)phenolate

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)phenolate Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)phenolate CAS Name: 2-(1,3-benzothiazol-2-yl)-4-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]phenolate IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)phenolate Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)phenolate Formula: C22H15N2O4S- MolecularWeight: 403.4305

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC(=C(C=C3)[O-])C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC(=C(C=C3)[O-])C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H16N2O4S/c25-17-7-6-14(12-15(17)22-24-16-3-1-2-4-20(16)29-22)23-21(26)13-5-8-18-19(11-13)28-10-9-27-18/h1-8,11-12,25H,9-10H2,(H,23,26)/p-1