O4-(1,3-benzoxazol-2-ylmethyl) O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-(1,3-benzoxazol-2-ylmethyl) O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-(1,3-benzoxazol-2-ylmethyl) O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-(1,3-benzoxazol-2-ylmethyl) ester O2-ethyl ester IUPAC Name: 4-O-(1,3-benzoxazol-2-ylmethyl) 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-(1,3-benzoxazol-2-ylmethyl) ester O2-ethyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C18H18N2O5/c1-4-23-18(22)16-10(2)15(11(3)19-16)17(21)24-9-14-20-12-7-5-6-8-13(12)25-14/h5-8,19H,4,9H2,1-3H3