2-[2-(2-nitropyridin-3-yl)oxyethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[2-(2-nitropyridin-3-yl)oxyethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[2-[(2-nitro-3-pyridyl)oxy]ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-[(2-nitro-3-pyridinyl)oxy]ethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[2-(2-nitropyridin-3-yl)oxyethyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[2-[(2-nitro-3-pyridyl)oxy]ethyl]-1,2-benzothiazol-3-one Formula: C14H11N3O6S MolecularWeight: 349.31864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCOC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCOC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O6S/c18-14-10-4-1-2-6-12(10)24(21,22)16(14)8-9-23-11-5-3-7-15-13(11)17(19)20/h1-7H,8-9H2