(4-pyrrolidin-1-ylcarbonylphenyl)methyl 3-cyanobenzoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 3-cyanobenzoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)COC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H18N2O3/c21-13-16-4-3-5-18(12-16)20(24)25-14-15-6-8-17(9-7-15)19(23)22-10-1-2-11-22/h3-9,12H,1-2,10-11,14H2