(1-cyanoindolizin-2-yl)methyl 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 3-chloro-4-isopropoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-propan-2-yloxybenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 3-chloro-5-methoxy-4-propan-2-yloxybenzoate Traditional Name: 3-chloro-4-isopropoxy-5-methoxy-benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C(=O)OCC2=CN3C=CC=CC3=C2C#N)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)C(=O)OCC2=CN3C=CC=CC3=C2C#N)OC

InChI

InChI=1S/C21H19ClN2O4/c1-13(2)28-20-17(22)8-14(9-19(20)26-3)21(25)27-12-15-11-24-7-5-4-6-18(24)16(15)10-23/h4-9,11,13H,12H2,1-3H3