[7-(1,3-benzothiazol-2-yl)heptanoylamino] 2-acetyloxybenzoate

Systemtic Name: [7-(1,3-benzothiazol-2-yl)heptanoylamino] 2-acetyloxybenzoate Openeye Name: [7-(1,3-benzothiazol-2-yl)heptanoylamino] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [[7-(1,3-benzothiazol-2-yl)-1-oxoheptyl]amino] ester IUPAC Name: [7-(1,3-benzothiazol-2-yl)heptanoylamino] 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [7-(1,3-benzothiazol-2-yl)heptanoylamino] ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)ONC(=O)CCCCCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)ONC(=O)CCCCCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C23H24N2O5S/c1-16(26)29-19-12-8-6-10-17(19)23(28)30-25-21(27)14-4-2-3-5-15-22-24-18-11-7-9-13-20(18)31-22/h6-13H,2-5,14-15H2,1H3,(H,25,27)