2-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[2-(azocan-1-yl)-2-oxo-ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-(1-azocanyl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[2-(azocan-1-yl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[2-(azocan-1-yl)-2-keto-ethyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

C1CCCN(CCC1)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H20N2O4S/c19-15(17-10-6-2-1-3-7-11-17)12-18-16(20)13-8-4-5-9-14(13)23(18,21)22/h4-5,8-9H,1-3,6-7,10-12H2