(E)-3-(1,3-benzoxazol-2-yl)-4-(3-methoxy-2-propan-2-yloxy-phenyl)but-3-enoate

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-methoxy-2-propan-2-yloxy-phenyl)but-3-enoate Openeye Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(2-isopropoxy-3-methoxy-phenyl)but-3-enoate CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-methoxy-2-propan-2-yloxyphenyl)-3-butenoate IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-methoxy-2-propan-2-yloxyphenyl)but-3-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(2-isopropoxy-3-methoxy-phenyl)but-3-enoate Formula: C21H20NO5- MolecularWeight: 366.3872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC=C1OC)C=C(CC(=O)[O-])C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C)OC1=C(C=CC=C1OC)/C=C(\CC(=O)[O-])/C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C21H21NO5/c1-13(2)26-20-14(7-6-10-18(20)25-3)11-15(12-19(23)24)21-22-16-8-4-5-9-17(16)27-21/h4-11,13H,12H2,1-3H3,(H,23,24)/p-1/b15-11+