(2S)-2-[[(2S)-1-ethoxy-1-oxidanylidene-7-(1-phenylmethoxycarbonylpiperidin-4-yl)heptan-2-yl]amino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-1-ethoxy-1-oxidanylidene-7-(1-phenylmethoxycarbonylpiperidin-4-yl)heptan-2-yl]amino]propanoic acid Openeye Name: (2S)-2-[[(1S)-6-(1-benzyloxycarbonyl-4-piperidyl)-1-ethoxycarbonyl-hexyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-1-ethoxy-1-oxo-7-(1-phenylmethoxycarbonyl-4-piperidinyl)heptan-2-yl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-1-ethoxy-1-oxo-7-(1-phenylmethoxycarbonylpiperidin-4-yl)heptan-2-yl]amino]propanoic acid Traditional Name: (2S)-2-[[(1S)-1-carbethoxy-6-(1-carbobenzoxy-4-piperidyl)hexyl]amino]propionic acid Formula: C25H38N2O6 MolecularWeight: 462.57902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)NC(C)C(=O)O

Isomeric SMILES

CCOC(=O)[C@H](CCCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)N[C@@H](C)C(=O)O

InChI

InChI=1S/C25H38N2O6/c1-3-32-24(30)22(26-19(2)23(28)29)13-9-5-6-10-20-14-16-27(17-15-20)25(31)33-18-21-11-7-4-8-12-21/h4,7-8,11-12,19-20,22,26H,3,5-6,9-10,13-18H2,1-2H3,(H,28,29)/t19-,22-/m0/s1