(1-cyanoindolizin-2-yl)methyl 4-oxidanylbenzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 4-oxidanylbenzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C17H12N2O3 MolecularWeight: 292.28878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=CC=C(C=C3)O)C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=CC=C(C=C3)O)C#N

InChI

InChI=1S/C17H12N2O3/c18-9-15-13(10-19-8-2-1-3-16(15)19)11-22-17(21)12-4-6-14(20)7-5-12/h1-8,10,20H,11H2