cyclohexylmethyl 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanoate

Systemtic Name: cyclohexylmethyl 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanoate Openeye Name: cyclohexylmethyl 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoate CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoate Traditional Name: 6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanoic acid cyclohexylmethyl ester Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC(=O)CCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C1CCC(CC1)COC(=O)CCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H28N2O4S/c23-19(26-15-16-9-3-1-4-10-16)13-5-2-8-14-21-20-17-11-6-7-12-18(17)27(24,25)22-20/h6-7,11-12,16H,1-5,8-10,13-15H2,(H,21,22)