1,3-benzothiazol-2-ylmethyl 4-tert-butylbenzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-tert-butylbenzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19NO2S/c1-19(2,3)14-10-8-13(9-11-14)18(21)22-12-17-20-15-6-4-5-7-16(15)23-17/h4-11H,12H2,1-3H3