methyl 4-[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]benzoate CAS Name: 4-[[2-[4-(1,3-benzothiazol-2-yl)-1-oxobutoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(1,3-benzothiazol-2-yl)butanoyloxy]acetyl]amino]benzoic acid methyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H20N2O5S/c1-27-21(26)14-9-11-15(12-10-14)22-18(24)13-28-20(25)8-4-7-19-23-16-5-2-3-6-17(16)29-19/h2-3,5-6,9-12H,4,7-8,13H2,1H3,(H,22,24)