3-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethoxy)benzoate

Systemtic Name: 3-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethoxy)benzoate Openeye Name: 3-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethoxy)benzoate CAS Name: 3-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethoxy)benzoate IUPAC Name: 3-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethoxy)benzoate Traditional Name: 3-methoxy-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethoxy)benzoate Formula: C16H16NO4S- MolecularWeight: 318.36754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)[O-])OCC2=NC3=C(S2)CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)[O-])OCC2=NC3=C(S2)CCCC3

InChI

InChI=1S/C16H17NO4S/c1-20-13-8-10(16(18)19)6-7-12(13)21-9-15-17-11-4-2-3-5-14(11)22-15/h6-8H,2-5,9H2,1H3,(H,18,19)/p-1