1,3-benzothiazol-2-ylmethyl (E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoate Openeye Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-2-propenoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(3-fluoro-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)acrylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H14FNO3S MolecularWeight: 343.372063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14FNO3S/c1-22-15-8-6-12(10-13(15)19)7-9-18(21)23-11-17-20-14-4-2-3-5-16(14)24-17/h2-10H,11H2,1H3/b9-7+