2-azanyl-2-butyl-3-oxidanylidene-pentacosanoic acid

Systemtic Name: 2-azanyl-2-butyl-3-oxidanylidene-pentacosanoic acid Openeye Name: 2-amino-2-butyl-3-oxo-pentacosanoic acid CAS Name: 2-amino-2-butyl-3-oxopentacosanoic acid IUPAC Name: 2-amino-2-butyl-3-oxopentacosanoic acid Traditional Name: 2-amino-2-butyl-3-keto-pentacosanoic acid Formula: C29H57NO3 MolecularWeight: 467.76778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(=O)C(CCCC)(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC(=O)C(CCCC)(C(=O)O)N

InChI

InChI=1S/C29H57NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-27(31)29(30,28(32)33)26-6-4-2/h3-26,30H2,1-2H3,(H,32,33)