1,1-bis(oxidanylidene)-2-[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]-1,2-benzothiazol-3-one Openeye Name: 2-[(1S)-1-benzyl-2-hydroxy-ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[(1S)-1-benzyl-2-hydroxy-ethyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CO)N2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](CO)N2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H15NO4S/c18-11-13(10-12-6-2-1-3-7-12)17-16(19)14-8-4-5-9-15(14)22(17,20)21/h1-9,13,18H,10-11H2/t13-/m0/s1