methyl 5-(phenylcarbonyl)-2-(2-pyrrolidin-1-ylethoxy)benzoate

Systemtic Name: methyl 5-(phenylcarbonyl)-2-(2-pyrrolidin-1-ylethoxy)benzoate Openeye Name: methyl 5-benzoyl-2-(2-pyrrolidin-1-ylethoxy)benzoate CAS Name: 5-benzoyl-2-[2-(1-pyrrolidinyl)ethoxy]benzoic acid methyl ester IUPAC Name: methyl 5-benzoyl-2-(2-pyrrolidin-1-ylethoxy)benzoate Traditional Name: 5-benzoyl-2-(2-pyrrolidinoethoxy)benzoic acid methyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OCCN3CCCC3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)C(=O)C2=CC=CC=C2)OCCN3CCCC3

InChI

InChI=1S/C21H23NO4/c1-25-21(24)18-15-17(20(23)16-7-3-2-4-8-16)9-10-19(18)26-14-13-22-11-5-6-12-22/h2-4,7-10,15H,5-6,11-14H2,1H3