ethyl 3-[2-[1-(2-azanyl-3-methyl-butanoyl)pyrrolidin-2-yl]-2-oxidanyl-ethanoyl]octanoate

Systemtic Name: ethyl 3-[2-[1-(2-azanyl-3-methyl-butanoyl)pyrrolidin-2-yl]-2-oxidanyl-ethanoyl]octanoate Openeye Name: ethyl 3-[2-[1-(2-amino-3-methyl-butanoyl)pyrrolidin-2-yl]-2-hydroxy-acetyl]octanoate CAS Name: 3-[2-[1-(2-amino-3-methyl-1-oxobutyl)-2-pyrrolidinyl]-2-hydroxy-1-oxoethyl]octanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[1-(2-amino-3-methylbutanoyl)pyrrolidin-2-yl]-2-hydroxyacetyl]octanoate Traditional Name: 3-[2-[1-(2-amino-3-methyl-butanoyl)pyrrolidin-2-yl]-2-hydroxy-acetyl]caprylic acid ethyl ester Formula: C21H38N2O5 MolecularWeight: 398.53682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)OCC)C(=O)C(C1CCCN1C(=O)C(C(C)C)N)O

Isomeric SMILES

CCCCCC(CC(=O)OCC)C(=O)C(C1CCCN1C(=O)C(C(C)C)N)O

InChI

InChI=1S/C21H38N2O5/c1-5-7-8-10-15(13-17(24)28-6-2)19(25)20(26)16-11-9-12-23(16)21(27)18(22)14(3)4/h14-16,18,20,26H,5-13,22H2,1-4H3