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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H16ClNO4S MolecularWeight: 377.84194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H16ClNO4S/c1-3-23-17-12(19)8-11(9-14(17)22-2)18(21)24-10-16-20-13-6-4-5-7-15(13)25-16/h4-9H,3,10H2,1-2H3