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

Systemtic Name: phenacyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: phenacyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid phenacyl ester IUPAC Name: phenacyl (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid phenacyl ester Formula: C18H13NO3S MolecularWeight: 323.36572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13NO3S/c20-15(13-6-2-1-3-7-13)12-22-18(21)11-10-17-19-14-8-4-5-9-16(14)23-17/h1-11H,12H2/b11-10+