4-(2,3-dihydro-1,4-benzodithiin-6-ylcarbonylamino)benzoic acid

Systemtic Name: 4-(2,3-dihydro-1,4-benzodithiin-6-ylcarbonylamino)benzoic acid Openeye Name: 4-(2,3-dihydro-1,4-benzodithiine-6-carbonylamino)benzoic acid CAS Name: 4-[[2,3-dihydro-1,4-benzodithiin-6-yl(oxo)methyl]amino]benzoic acid IUPAC Name: 4-(2,3-dihydro-1,4-benzodithiine-6-carbonylamino)benzoic acid Traditional Name: 4-(2,3-dihydro-1,4-benzodithiin-6-carbonylamino)benzoic acid Formula: C16H13NO3S2 MolecularWeight: 331.40932

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(S1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CSC2=C(S1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13NO3S2/c18-15(17-12-4-1-10(2-5-12)16(19)20)11-3-6-13-14(9-11)22-8-7-21-13/h1-6,9H,7-8H2,(H,17,18)(H,19,20)