(1-cyanoindolizin-2-yl)methyl 3,4-diethoxybenzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 3,4-diethoxybenzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=CN3C=CC=CC3=C2C#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=CN3C=CC=CC3=C2C#N)OCC

InChI

InChI=1S/C21H20N2O4/c1-3-25-19-9-8-15(11-20(19)26-4-2)21(24)27-14-16-13-23-10-6-5-7-18(23)17(16)12-22/h5-11,13H,3-4,14H2,1-2H3