heptanoic acid; (1S,2S,4S)-N-methyl-2-(oxan-2-yloxy)-4-phenylmethoxy-cyclopentan-1-amine

Systemtic Name: heptanoic acid; (1S,2S,4S)-N-methyl-2-(oxan-2-yloxy)-4-phenylmethoxy-cyclopentan-1-amine Openeye Name: (1S,2S,4S)-4-benzyloxy-N-methyl-2-tetrahydropyran-2-yloxy-cyclopentanamine; heptanoic acid CAS Name: heptanoic acid; (1S,2S,4S)-N-methyl-2-(2-oxanyloxy)-4-phenylmethoxy-1-cyclopentanamine IUPAC Name: heptanoic acid; (1S,2S,4S)-N-methyl-2-(oxan-2-yloxy)-4-phenylmethoxycyclopentan-1-amine Traditional Name: [(1S,2S,4S)-4-benzoxy-2-tetrahydropyran-2-yloxy-cyclopentyl]-methyl-amine; enanthic acid Formula: C25H41NO5 MolecularWeight: 435.59674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)O.CNC1CC(CC1OC2CCCCO2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(=O)O.CN[C@H]1C[C@@H](C[C@@H]1OC2CCCCO2)OCC3=CC=CC=C3

InChI

InChI=1S/C18H27NO3.C7H14O2/c1-19-16-11-15(21-13-14-7-3-2-4-8-14)12-17(16)22-18-9-5-6-10-20-18;1-2-3-4-5-6-7(8)9/h2-4,7-8,15-19H,5-6,9-13H2,1H3;2-6H2,1H3,(H,8,9)/t15-,16-,17-,18?;/m0./s1