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

Systemtic Name: cyclohexylmethyl 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butanoate Openeye Name: cyclohexylmethyl 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 cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 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 cyclohexylmethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC(=O)CCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C1CCC(CC1)COC(=O)CCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H24N2O4S/c21-17(24-13-14-7-2-1-3-8-14)11-6-12-19-18-15-9-4-5-10-16(15)25(22,23)20-18/h4-5,9-10,14H,1-3,6-8,11-13H2,(H,19,20)