1,1-bis(oxidanylidene)-2-(3-phenylpropyl)-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-(3-phenylpropyl)-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-(3-phenylpropyl)-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-(3-phenylpropyl)-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-(3-phenylpropyl)-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-(3-phenylpropyl)-1,2-benzothiazol-3-one Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H15NO3S/c18-16-14-10-4-5-11-15(14)21(19,20)17(16)12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11H,6,9,12H2