(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C18H12N2O3S MolecularWeight: 336.36448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C=CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)/C=C/C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H12N2O3S/c19-11-14-5-3-13(4-6-14)7-8-18(21)22-12-15-10-16(23-20-15)17-2-1-9-24-17/h1-10H,12H2/b8-7+