2-[2-[3-(2-methylprop-2-enoylamino)propylamino]-2-oxidanylidene-ethyl]hexadecanoic acid

Systemtic Name: 2-[2-[3-(2-methylprop-2-enoylamino)propylamino]-2-oxidanylidene-ethyl]hexadecanoic acid Openeye Name: 2-[2-[3-(2-methylprop-2-enoylamino)propylamino]-2-oxo-ethyl]hexadecanoic acid CAS Name: 2-[2-[3-[(2-methyl-1-oxoprop-2-enyl)amino]propylamino]-2-oxoethyl]hexadecanoic acid IUPAC Name: 2-[2-[3-(2-methylprop-2-enoylamino)propylamino]-2-oxoethyl]hexadecanoic acid Traditional Name: 2-[2-keto-2-(3-methacrylamidopropylamino)ethyl]palmitic acid Formula: C25H46N2O4 MolecularWeight: 438.64374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CC(=O)NCCCNC(=O)C(=C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC(CC(=O)NCCCNC(=O)C(=C)C)C(=O)O

InChI

InChI=1S/C25H46N2O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-22(25(30)31)20-23(28)26-18-16-19-27-24(29)21(2)3/h22H,2,4-20H2,1,3H3,(H,26,28)(H,27,29)(H,30,31)