1-[(2R,3S)-3-aminocarbonyl-2-(2-methylpropyl)hexanoyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2R,3S)-3-aminocarbonyl-2-(2-methylpropyl)hexanoyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2R,3S)-3-carbamoyl-2-isobutyl-hexanoyl]piperidine-2-carboxylic acid CAS Name: 1-[(2R,3S)-3-carbamoyl-2-(2-methylpropyl)-1-oxohexyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2R,3S)-3-carbamoyl-2-(2-methylpropyl)hexanoyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2R,3S)-3-carbamoyl-2-isobutyl-hexanoyl]pipecolinic acid Formula: C17H30N2O4 MolecularWeight: 326.4311

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCCCC1C(=O)O)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCCCC1C(=O)O)C(=O)N

InChI

InChI=1S/C17H30N2O4/c1-4-7-12(15(18)20)13(10-11(2)3)16(21)19-9-6-5-8-14(19)17(22)23/h11-14H,4-10H2,1-3H3,(H2,18,20)(H,22,23)/t12-,13+,14?/m0/s1