2-[2-azanylethanoyl-[(E)-18-azanyl-18-oxidanylidene-octadec-9-enyl]amino]ethanoic acid

Systemtic Name: 2-[2-azanylethanoyl-[(E)-18-azanyl-18-oxidanylidene-octadec-9-enyl]amino]ethanoic acid Openeye Name: 2-[(2-aminoacetyl)-[(E)-18-amino-18-oxo-octadec-9-enyl]amino]acetic acid CAS Name: 2-[(2-amino-1-oxoethyl)-[(E)-18-amino-18-oxooctadec-9-enyl]amino]acetic acid IUPAC Name: 2-[(2-aminoacetyl)-[(E)-18-amino-18-oxooctadec-9-enyl]amino]acetic acid Traditional Name: 2-[[(E)-18-amino-18-keto-octadec-9-enyl]-glycyl-amino]acetic acid Formula: C22H41N3O4 MolecularWeight: 411.57864

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCN(CC(=O)O)C(=O)CN)CCCC=CCCCCCCCC(=O)N

Isomeric SMILES

C(CCCCN(CC(=O)O)C(=O)CN)CCC/C=C/CCCCCCCC(=O)N

InChI

InChI=1S/C22H41N3O4/c23-18-21(27)25(19-22(28)29)17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-20(24)26/h1-2H,3-19,23H2,(H2,24,26)(H,28,29)/b2-1+