7-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]heptanoate

Systemtic Name: 7-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]heptanoate Openeye Name: 7-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]heptanoate CAS Name: 7-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]heptanoate IUPAC Name: 7-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]heptanoate Traditional Name: 7-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]enanthate Formula: C14H17N2O4S- MolecularWeight: 309.36078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCCCCC(=O)[O-]

InChI

InChI=1S/C14H18N2O4S/c17-13(18)9-3-1-2-6-10-15-14-11-7-4-5-8-12(11)21(19,20)16-14/h4-5,7-8H,1-3,6,9-10H2,(H,15,16)(H,17,18)/p-1