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

Systemtic Name: (4-propanoylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (4-propanoylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (4-propionylphenyl) ester Formula: C19H15NO3S MolecularWeight: 337.3923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H15NO3S/c1-2-16(21)13-7-9-14(10-8-13)23-19(22)12-11-18-20-15-5-3-4-6-17(15)24-18/h3-12H,2H2,1H3/b12-11+