4-azanyl-2-(octadecan-2-ylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-(octadecan-2-ylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-(1-methylheptadecylamino)-4-oxo-butanoic acid CAS Name: 4-amino-2-(octadecan-2-ylamino)-4-oxobutanoic acid IUPAC Name: 4-amino-2-(octadecan-2-ylamino)-4-oxobutanoic acid Traditional Name: 4-amino-4-keto-2-(1-methylheptadecylamino)butyric acid Formula: C22H44N2O3 MolecularWeight: 384.59636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H44N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(2)24-20(22(26)27)18-21(23)25/h19-20,24H,3-18H2,1-2H3,(H2,23,25)(H,26,27)