(4-nitrophenyl)methyl 3-[oxidanyl(pyrrolidin-1-yl)methyl]piperidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-[oxidanyl(pyrrolidin-1-yl)methyl]piperidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-[hydroxy(pyrrolidin-1-yl)methyl]piperidine-1-carboxylate CAS Name: 3-[hydroxy(1-pyrrolidinyl)methyl]-1-piperidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[hydroxy(pyrrolidin-1-yl)methyl]piperidine-1-carboxylate Traditional Name: 3-[hydroxy(pyrrolidino)methyl]piperidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2CCCN(C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CCN(C1)C(C2CCCN(C2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H25N3O5/c22-17(19-9-1-2-10-19)15-4-3-11-20(12-15)18(23)26-13-14-5-7-16(8-6-14)21(24)25/h5-8,15,17,22H,1-4,9-13H2