1,1-bis(oxidanylidene)-2-[4-(4-phenylmethoxyphenoxy)butyl]-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-[4-(4-phenylmethoxyphenoxy)butyl]-1,2-benzothiazol-3-one Openeye Name: 2-[4-(4-benzyloxyphenoxy)butyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[4-(4-phenylmethoxyphenoxy)butyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-[4-(4-phenylmethoxyphenoxy)butyl]-1,2-benzothiazol-3-one Traditional Name: 2-[4-(4-benzoxyphenoxy)butyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C24H23NO5S/c26-24-22-10-4-5-11-23(22)31(27,28)25(24)16-6-7-17-29-20-12-14-21(15-13-20)30-18-19-8-2-1-3-9-19/h1-5,8-15H,6-7,16-18H2