2-[[[1-(2-piperidin-4-ylcyclopropyl)carbonylpiperidin-3-yl]carbonylamino]methyl]but-3-ynoic acid

Systemtic Name: 2-[[[1-(2-piperidin-4-ylcyclopropyl)carbonylpiperidin-3-yl]carbonylamino]methyl]but-3-ynoic acid Openeye Name: 2-[[[1-[2-(4-piperidyl)cyclopropanecarbonyl]piperidine-3-carbonyl]amino]methyl]but-3-ynoic acid CAS Name: 2-[[[oxo-[1-[oxo-[2-(4-piperidinyl)cyclopropyl]methyl]-3-piperidinyl]methyl]amino]methyl]-3-butynoic acid IUPAC Name: 2-[[[1-(2-piperidin-4-ylcyclopropanecarbonyl)piperidine-3-carbonyl]amino]methyl]but-3-ynoic acid Traditional Name: 2-[[[1-[2-(4-piperidyl)cyclopropanecarbonyl]nipecotoyl]amino]methyl]but-3-ynoic acid Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(CNC(=O)C1CCCN(C1)C(=O)C2CC2C3CCNCC3)C(=O)O

Isomeric SMILES

C#CC(CNC(=O)C1CCCN(C1)C(=O)C2CC2C3CCNCC3)C(=O)O

InChI

InChI=1S/C20H29N3O4/c1-2-13(20(26)27)11-22-18(24)15-4-3-9-23(12-15)19(25)17-10-16(17)14-5-7-21-8-6-14/h1,13-17,21H,3-12H2,(H,22,24)(H,26,27)