3-[5-[6-[bis(azanyl)methylideneamino]hexylamino]-5-oxidanylidene-pentyl]-2-methyl-2-oxidanyl-nonanoic acid

Systemtic Name: 3-[5-[6-[bis(azanyl)methylideneamino]hexylamino]-5-oxidanylidene-pentyl]-2-methyl-2-oxidanyl-nonanoic acid Openeye Name: 3-[5-(6-guanidinohexylamino)-5-oxo-pentyl]-2-hydroxy-2-methyl-nonanoic acid CAS Name: 3-[5-[6-(diaminomethylideneamino)hexylamino]-5-oxopentyl]-2-hydroxy-2-methylnonanoic acid IUPAC Name: 3-[5-[6-(diaminomethylideneamino)hexylamino]-5-oxopentyl]-2-hydroxy-2-methylnonanoic acid Traditional Name: 3-[5-(6-guanidinohexylamino)-5-keto-pentyl]-2-hydroxy-2-methyl-pelargonic acid Formula: C22H44N4O4 MolecularWeight: 428.60916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCC(=O)NCCCCCCN=C(N)N)C(C)(C(=O)O)O

Isomeric SMILES

CCCCCCC(CCCCC(=O)NCCCCCCN=C(N)N)C(C)(C(=O)O)O

InChI

InChI=1S/C22H44N4O4/c1-3-4-5-8-13-18(22(2,30)20(28)29)14-9-10-15-19(27)25-16-11-6-7-12-17-26-21(23)24/h18,30H,3-17H2,1-2H3,(H,25,27)(H,28,29)(H4,23,24,26)