(1-cyanoindolizin-2-yl)methyl 3-methoxy-4-propan-2-yloxy-benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 3-methoxy-4-propan-2-yloxy-benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 4-isopropoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-propan-2-yloxybenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 3-methoxy-4-propan-2-yloxybenzoate Traditional Name: 4-isopropoxy-3-methoxy-benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)OCC2=CN3C=CC=CC3=C2C#N)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)OCC2=CN3C=CC=CC3=C2C#N)OC

InChI

InChI=1S/C21H20N2O4/c1-14(2)27-19-8-7-15(10-20(19)25-3)21(24)26-13-16-12-23-9-5-4-6-18(23)17(16)11-22/h4-10,12,14H,13H2,1-3H3