4-methyl-2-(octadecylcarbamoylamino)pentanoic acid

Systemtic Name: 4-methyl-2-(octadecylcarbamoylamino)pentanoic acid Openeye Name: 4-methyl-2-(octadecylcarbamoylamino)pentanoic acid CAS Name: 4-methyl-2-[[(octadecylamino)-oxomethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-(octadecylcarbamoylamino)pentanoic acid Traditional Name: 4-methyl-2-(stearylcarbamoylamino)valeric acid Formula: C25H50N2O3 MolecularWeight: 426.6761

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C25H50N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-25(30)27-23(24(28)29)21-22(2)3/h22-23H,4-21H2,1-3H3,(H,28,29)(H2,26,27,30)