(2-cyanophenyl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (2-cyanophenyl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (2-cyanophenyl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (2-cyanobenzyl) ester Formula: C18H12N2O2S MolecularWeight: 320.36508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C=CC2=NC3=CC=CC=C3S2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)/C=C/C2=NC3=CC=CC=C3S2)C#N

InChI

InChI=1S/C18H12N2O2S/c19-11-13-5-1-2-6-14(13)12-22-18(21)10-9-17-20-15-7-3-4-8-16(15)23-17/h1-10H,12H2/b10-9+