4-(1,3-benzothiazol-2-yl)-3-chloranyl-4-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-3-chloranyl-4-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-(1,3-benzothiazol-2-yl)-3-chloro-4-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-(1,3-benzothiazol-2-yl)-3-chloro-4-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-(1,3-benzothiazol-2-yl)-3-chloro-4-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-(1,3-benzothiazol-2-yl)-3-chloro-4-hydroxy-cyclohexa-2,5-dien-1-one Formula: C13H8ClNO2S MolecularWeight: 277.72612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3(C=CC(=O)C=C3Cl)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3(C=CC(=O)C=C3Cl)O

InChI

InChI=1S/C13H8ClNO2S/c14-11-7-8(16)5-6-13(11,17)12-15-9-3-1-2-4-10(9)18-12/h1-7,17H