(E)-3-(1,3-benzoxazol-2-yl)-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]but-3-enoate

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]but-3-enoate Openeye Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-ethoxy-4-isobutoxy-phenyl)but-3-enoate CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-3-butenoate IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]but-3-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-ethoxy-4-isobutoxy-phenyl)but-3-enoate Formula: C23H24NO5- MolecularWeight: 394.44036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(CC(=O)[O-])C2=NC3=CC=CC=C3O2)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\CC(=O)[O-])/C2=NC3=CC=CC=C3O2)OCC(C)C

InChI

InChI=1S/C23H25NO5/c1-4-27-21-12-16(9-10-20(21)28-14-15(2)3)11-17(13-22(25)26)23-24-18-7-5-6-8-19(18)29-23/h5-12,15H,4,13-14H2,1-3H3,(H,25,26)/p-1/b17-11+