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

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl (E)-3-(2-chlorophenyl)prop-2-enoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl (E)-3-(2-chlorophenyl)prop-2-enoate CAS Name: (E)-3-(2-chlorophenyl)-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-(2-chlorophenyl)prop-2-enoate Traditional Name: (E)-3-(2-chlorophenyl)acrylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C17H12ClNO3S MolecularWeight: 345.80008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)OCC2=NOC(=C2)C3=CC=CS3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)OCC2=NOC(=C2)C3=CC=CS3)Cl

InChI

InChI=1S/C17H12ClNO3S/c18-14-5-2-1-4-12(14)7-8-17(20)21-11-13-10-15(22-19-13)16-6-3-9-23-16/h1-10H,11H2/b8-7+