methyl (3S)-3-(5-phenethylpyridin-3-yl)-3-[[(3R)-piperidin-3-yl]carbonylamino]propanoate

Systemtic Name: methyl (3S)-3-(5-phenethylpyridin-3-yl)-3-[[(3R)-piperidin-3-yl]carbonylamino]propanoate Openeye Name: methyl (3S)-3-(5-phenethyl-3-pyridyl)-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate CAS Name: (3S)-3-[[oxo-[(3R)-3-piperidinyl]methyl]amino]-3-(5-phenethyl-3-pyridinyl)propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(5-phenethylpyridin-3-yl)-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate Traditional Name: (3S)-3-[[(3R)-nipecotoyl]amino]-3-(5-phenethyl-3-pyridyl)propionic acid methyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CN=CC(=C1)CCC2=CC=CC=C2)NC(=O)C3CCCNC3

Isomeric SMILES

COC(=O)C[C@@H](C1=CN=CC(=C1)CCC2=CC=CC=C2)NC(=O)[C@@H]3CCCNC3

InChI

InChI=1S/C23H29N3O3/c1-29-22(27)13-21(26-23(28)19-8-5-11-24-15-19)20-12-18(14-25-16-20)10-9-17-6-3-2-4-7-17/h2-4,6-7,12,14,16,19,21,24H,5,8-11,13,15H2,1H3,(H,26,28)/t19-,21+/m1/s1