1,3-benzothiazol-2-ylmethyl 4-methoxy-2-oxidanyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-methoxy-2-oxidanyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-hydroxy-4-methoxy-benzoate CAS Name: 2-hydroxy-4-methoxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-hydroxy-4-methoxybenzoate Traditional Name: 2-hydroxy-4-methoxy-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C16H13NO4S/c1-20-10-6-7-11(13(18)8-10)16(19)21-9-15-17-12-4-2-3-5-14(12)22-15/h2-8,18H,9H2,1H3