1,3-benzothiazol-2-ylmethyl (E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoate Openeye Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoate CAS Name: (E)-3-(2-methoxy-5-methylphenyl)-2-propenoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(2-methoxy-5-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(2-methoxy-5-methyl-phenyl)acrylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)OCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H17NO3S/c1-13-7-9-16(22-2)14(11-13)8-10-19(21)23-12-18-20-15-5-3-4-6-17(15)24-18/h3-11H,12H2,1-2H3/b10-8+