methyl 4-[[(2S,4R)-4-chloranylpyrrolidin-2-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[(2S,4R)-4-chloranylpyrrolidin-2-yl]methoxy]benzoate Openeye Name: methyl 4-[[(2S,4R)-4-chloropyrrolidin-2-yl]methoxy]benzoate CAS Name: 4-[[(2S,4R)-4-chloro-2-pyrrolidinyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S,4R)-4-chloropyrrolidin-2-yl]methoxy]benzoate Traditional Name: 4-[[(2S,4R)-4-chloropyrrolidin-2-yl]methoxy]benzoic acid methyl ester Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC2CC(CN2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC[C@@H]2C[C@H](CN2)Cl

InChI

InChI=1S/C13H16ClNO3/c1-17-13(16)9-2-4-12(5-3-9)18-8-11-6-10(14)7-15-11/h2-5,10-11,15H,6-8H2,1H3/t10-,11+/m1/s1