methyl 2-methoxy-5-[(2R)-pyrrolidin-1-ium-2-yl]benzoate

Systemtic Name: methyl 2-methoxy-5-[(2R)-pyrrolidin-1-ium-2-yl]benzoate Openeye Name: methyl 2-methoxy-5-[(2R)-pyrrolidin-1-ium-2-yl]benzoate CAS Name: 2-methoxy-5-[(2R)-2-pyrrolidin-1-iumyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[(2R)-pyrrolidin-1-ium-2-yl]benzoate Traditional Name: 2-methoxy-5-[(2R)-pyrrolidin-1-ium-2-yl]benzoic acid methyl ester Formula: C13H18NO3+ MolecularWeight: 236.28692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCC[NH2+]2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CCC[NH2+]2)C(=O)OC

InChI

InChI=1S/C13H17NO3/c1-16-12-6-5-9(11-4-3-7-14-11)8-10(12)13(15)17-2/h5-6,8,11,14H,3-4,7H2,1-2H3/p+1/t11-/m1/s1