heptanoic acid; (1R,2R,4R)-2-(methylamino)-4-phenylmethoxy-cyclopentan-1-ol

Systemtic Name: heptanoic acid; (1R,2R,4R)-2-(methylamino)-4-phenylmethoxy-cyclopentan-1-ol Openeye Name: (1R,2R,4R)-4-benzyloxy-2-(methylamino)cyclopentanol; heptanoic acid CAS Name: heptanoic acid; (1R,2R,4R)-2-(methylamino)-4-phenylmethoxy-1-cyclopentanol IUPAC Name: heptanoic acid; (1R,2R,4R)-2-(methylamino)-4-phenylmethoxycyclopentan-1-ol Traditional Name: (1R,2R,4R)-4-benzoxy-2-(methylamino)cyclopentanol; enanthic acid Formula: C20H33NO4 MolecularWeight: 351.48032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)O.CNC1CC(CC1O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC(=O)O.CN[C@@H]1C[C@H](C[C@H]1O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H19NO2.C7H14O2/c1-14-12-7-11(8-13(12)15)16-9-10-5-3-2-4-6-10;1-2-3-4-5-6-7(8)9/h2-6,11-15H,7-9H2,1H3;2-6H2,1H3,(H,8,9)/t11-,12-,13-;/m1./s1