1,3-benzothiazol-2-ylmethyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H14ClNO4S MolecularWeight: 363.81536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3S2)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3S2)Cl)O

InChI

InChI=1S/C17H14ClNO4S/c1-2-22-13-8-10(7-11(18)16(13)20)17(21)23-9-15-19-12-5-3-4-6-14(12)24-15/h3-8,20H,2,9H2,1H3