2-[[(1S,2S)-2-(phenylcarbonyl)cyclohexyl]carbonylamino]-3-piperidin-1-yl-propanoic acid

Systemtic Name: 2-[[(1S,2S)-2-(phenylcarbonyl)cyclohexyl]carbonylamino]-3-piperidin-1-yl-propanoic acid Openeye Name: 2-[[(1S,2S)-2-benzoylcyclohexanecarbonyl]amino]-3-(1-piperidyl)propanoic acid CAS Name: 2-[[[(1S,2S)-2-benzoylcyclohexyl]-oxomethyl]amino]-3-(1-piperidinyl)propanoic acid IUPAC Name: 2-[[(1S,2S)-2-benzoylcyclohexanecarbonyl]amino]-3-piperidin-1-ylpropanoic acid Traditional Name: 2-[[(1S,2S)-2-benzoylcyclohexanecarbonyl]amino]-3-piperidino-propionic acid Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(C(=O)O)NC(=O)C2CCCCC2C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CC(C(=O)O)NC(=O)[C@H]2CCCC[C@@H]2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O4/c25-20(16-9-3-1-4-10-16)17-11-5-6-12-18(17)21(26)23-19(22(27)28)15-24-13-7-2-8-14-24/h1,3-4,9-10,17-19H,2,5-8,11-15H2,(H,23,26)(H,27,28)/t17-,18-,19?/m0/s1