4-(cyclohexa-2,4-dien-1-ylcarbonylamino)benzenesulfinic acid

Systemtic Name: 4-(cyclohexa-2,4-dien-1-ylcarbonylamino)benzenesulfinic acid Openeye Name: 4-(cyclohexa-2,4-diene-1-carbonylamino)benzenesulfinic acid CAS Name: 4-[[1-cyclohexa-2,4-dienyl(oxo)methyl]amino]benzenesulfinic acid IUPAC Name: 4-(cyclohexa-2,4-diene-1-carbonylamino)benzenesulfinic acid Traditional Name: 4-(cyclohexa-2,4-diene-1-carbonylamino)benzenesulfinic acid Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=CC1C(=O)NC2=CC=C(C=C2)S(=O)O

Isomeric SMILES

C1C=CC=CC1C(=O)NC2=CC=C(C=C2)S(=O)O

InChI

InChI=1S/C13H13NO3S/c15-13(10-4-2-1-3-5-10)14-11-6-8-12(9-7-11)18(16)17/h1-4,6-10H,5H2,(H,14,15)(H,16,17)