4-[methoxy-(1-phenylmethoxycarbonylpyrrolidin-1-ium-1-yl)methoxy]benzoate

Systemtic Name: 4-[methoxy-(1-phenylmethoxycarbonylpyrrolidin-1-ium-1-yl)methoxy]benzoate Openeye Name: 4-[(1-benzyloxycarbonylpyrrolidin-1-ium-1-yl)-methoxy-methoxy]benzoate CAS Name: 4-[methoxy-(1-phenylmethoxycarbonyl-1-pyrrolidin-1-iumyl)methoxy]benzoate IUPAC Name: 4-[methoxy-(1-phenylmethoxycarbonylpyrrolidin-1-ium-1-yl)methoxy]benzoate Traditional Name: 4-[(1-carbobenzoxypyrrolidin-1-ium-1-yl)-methoxy-methoxy]benzoate Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

COC([N+]1(CCCC1)C(=O)OCC2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

COC([N+]1(CCCC1)C(=O)OCC2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C21H23NO6/c1-26-21(28-18-11-9-17(10-12-18)19(23)24)22(13-5-6-14-22)20(25)27-15-16-7-3-2-4-8-16/h2-4,7-12,21H,5-6,13-15H2,1H3