[(1R,2R,3R,5R)-2-azanyl-3,5-bis(hydroxymethyl)cyclopentyl] benzoate

Systemtic Name: [(1R,2R,3R,5R)-2-azanyl-3,5-bis(hydroxymethyl)cyclopentyl] benzoate Openeye Name: [(1R,2R,3R,5R)-2-amino-3,5-bis(hydroxymethyl)cyclopentyl] benzoate CAS Name: benzoic acid [(1R,2R,3R,5R)-2-amino-3,5-bis(hydroxymethyl)cyclopentyl] ester IUPAC Name: [(1R,2R,3R,5R)-2-amino-3,5-bis(hydroxymethyl)cyclopentyl] benzoate Traditional Name: benzoic acid [(1R,2R,3R,5R)-2-amino-3,5-dimethylol-cyclopentyl] ester Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1CO)OC(=O)C2=CC=CC=C2)N)CO

Isomeric SMILES

C1[C@H]([C@H]([C@@H]([C@H]1CO)OC(=O)C2=CC=CC=C2)N)CO

InChI

InChI=1S/C14H19NO4/c15-12-10(7-16)6-11(8-17)13(12)19-14(18)9-4-2-1-3-5-9/h1-5,10-13,16-17H,6-8,15H2/t10-,11+,12+,13+/m0/s1