1,3-benzothiazol-2-ylmethyl (E)-3-(2-methylphenyl)prop-2-enoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(2-methylphenyl)prop-2-enoate Openeye Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(o-tolyl)prop-2-enoate CAS Name: (E)-3-(2-methylphenyl)-2-propenoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl (E)-3-(2-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(o-tolyl)acrylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H15NO2S MolecularWeight: 309.3822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)OCC2=NC3=CC=CC=C3S2

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO2S/c1-13-6-2-3-7-14(13)10-11-18(20)21-12-17-19-15-8-4-5-9-16(15)22-17/h2-11H,12H2,1H3/b11-10+