2-(dimethylamino)-2-[[(E)-octadec-9-enoyl]amino]butanoic acid

Systemtic Name: 2-(dimethylamino)-2-[[(E)-octadec-9-enoyl]amino]butanoic acid Openeye Name: 2-(dimethylamino)-2-[[(E)-octadec-9-enoyl]amino]butanoic acid CAS Name: 2-(dimethylamino)-2-[[(E)-1-oxooctadec-9-enyl]amino]butanoic acid IUPAC Name: 2-(dimethylamino)-2-[[(E)-octadec-9-enoyl]amino]butanoic acid Traditional Name: 2-(dimethylamino)-2-[[(E)-octadec-9-enoyl]amino]butyric acid Formula: C24H46N2O3 MolecularWeight: 410.63364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(CC)(C(=O)O)N(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC(CC)(C(=O)O)N(C)C

InChI

InChI=1S/C24H46N2O3/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(27)25-24(6-2,23(28)29)26(3)4/h13-14H,5-12,15-21H2,1-4H3,(H,25,27)(H,28,29)/b14-13+