1-[1-azanyl-16-oxidanyl-2,16-bis(oxidanylidene)hexadecan-8-yl]-2-methyl-cyclobutane-1-carboxylic acid

Systemtic Name: 1-[1-azanyl-16-oxidanyl-2,16-bis(oxidanylidene)hexadecan-8-yl]-2-methyl-cyclobutane-1-carboxylic acid Openeye Name: 1-[1-(7-amino-6-oxo-heptyl)-9-hydroxy-9-oxo-nonyl]-2-methyl-cyclobutanecarboxylic acid CAS Name: 1-(1-amino-16-hydroxy-2,16-dioxohexadecan-8-yl)-2-methyl-1-cyclobutanecarboxylic acid IUPAC Name: 1-(1-amino-16-hydroxy-2,16-dioxohexadecan-8-yl)-2-methylcyclobutane-1-carboxylic acid Traditional Name: 1-[1-(7-amino-6-keto-heptyl)-9-hydroxy-9-keto-nonyl]-2-methyl-cyclobutanecarboxylic acid Formula: C22H39NO5 MolecularWeight: 397.54876

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC1(C(CCCCCCCC(=O)O)CCCCCC(=O)CN)C(=O)O

Isomeric SMILES

CC1CCC1(C(CCCCCCCC(=O)O)CCCCCC(=O)CN)C(=O)O

InChI

InChI=1S/C22H39NO5/c1-17-14-15-22(17,21(27)28)18(11-7-5-8-12-19(24)16-23)10-6-3-2-4-9-13-20(25)26/h17-18H,2-16,23H2,1H3,(H,25,26)(H,27,28)