2-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C15H10ClNO5S MolecularWeight: 351.7616

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CN3C(=O)C4=CC=CC=C4S3(=O)=O)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CN3C(=O)C4=CC=CC=C4S3(=O)=O)Cl

InChI

InChI=1S/C15H10ClNO5S/c16-11-5-9(6-12-14(11)22-8-21-12)7-17-15(18)10-3-1-2-4-13(10)23(17,19)20/h1-6H,7-8H2