1-[4-(dodecan-2-ylcarbamoyl)-2-methyl-hexanoyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[4-(dodecan-2-ylcarbamoyl)-2-methyl-hexanoyl]piperidine-2-carboxylic acid Openeye Name: 1-[2-methyl-4-(1-methylundecylcarbamoyl)hexanoyl]piperidine-2-carboxylic acid CAS Name: 1-[4-[(dodecan-2-ylamino)-oxomethyl]-2-methyl-1-oxohexyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[4-(dodecan-2-ylcarbamoyl)-2-methylhexanoyl]piperidine-2-carboxylic acid Traditional Name: 1-[2-methyl-4-(1-methylundecylcarbamoyl)hexanoyl]pipecolinic acid Formula: C26H48N2O4 MolecularWeight: 452.67032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)NC(=O)C(CC)CC(C)C(=O)N1CCCCC1C(=O)O

Isomeric SMILES

CCCCCCCCCCC(C)NC(=O)C(CC)CC(C)C(=O)N1CCCCC1C(=O)O

InChI

InChI=1S/C26H48N2O4/c1-5-7-8-9-10-11-12-13-16-21(4)27-24(29)22(6-2)19-20(3)25(30)28-18-15-14-17-23(28)26(31)32/h20-23H,5-19H2,1-4H3,(H,27,29)(H,31,32)