(2S)-2-[[2-(4-ethoxycarbonylpiperidin-1-yl)pyridin-3-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[2-(4-ethoxycarbonylpiperidin-1-yl)pyridin-3-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(4-ethoxycarbonyl-1-piperidyl)pyridine-3-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[[2-(4-ethoxycarbonyl-1-piperidinyl)-3-pyridinyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[2-(4-ethoxycarbonylpiperidin-1-yl)pyridine-3-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-(4-carbethoxypiperidino)nicotinoyl]amino]-3-phenyl-propionic acid Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=CC=N2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC=N2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H27N3O5/c1-2-31-23(30)17-10-13-26(14-11-17)20-18(9-6-12-24-20)21(27)25-19(22(28)29)15-16-7-4-3-5-8-16/h3-9,12,17,19H,2,10-11,13-15H2,1H3,(H,25,27)(H,28,29)/t19-/m0/s1