propyl 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butanoate

Systemtic Name: propyl 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butanoate Openeye Name: propyl 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoate CAS Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoic acid propyl ester IUPAC Name: propyl 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoate Traditional Name: 4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]butyric acid propyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCOC(=O)CCCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H18N2O4S/c1-2-10-20-13(17)8-5-9-15-14-11-6-3-4-7-12(11)21(18,19)16-14/h3-4,6-7H,2,5,8-10H2,1H3,(H,15,16)