(E)-3-(1,3-benzoxazol-2-yl)-4-(4-methylphenyl)but-3-enoate

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-methylphenyl)but-3-enoate Openeye Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(p-tolyl)but-3-enoate CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-methylphenyl)-3-butenoate IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-methylphenyl)but-3-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(p-tolyl)but-3-enoate Formula: C18H14NO3- MolecularWeight: 292.30866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(CC(=O)[O-])C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\CC(=O)[O-])/C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H15NO3/c1-12-6-8-13(9-7-12)10-14(11-17(20)21)18-19-15-4-2-3-5-16(15)22-18/h2-10H,11H2,1H3,(H,20,21)/p-1/b14-10+