[[1-(2-acetamido-3-methyl-butanoyl)pyrrolidin-2-yl]carbonylamino] 4-methyl-2-oxidanyl-pentanoate

Systemtic Name: [[1-(2-acetamido-3-methyl-butanoyl)pyrrolidin-2-yl]carbonylamino] 4-methyl-2-oxidanyl-pentanoate Openeye Name: [[1-(2-acetamido-3-methyl-butanoyl)pyrrolidine-2-carbonyl]amino] 2-hydroxy-4-methyl-pentanoate CAS Name: 2-hydroxy-4-methylpentanoic acid [[[1-(2-acetamido-3-methyl-1-oxobutyl)-2-pyrrolidinyl]-oxomethyl]amino] ester IUPAC Name: [[1-(2-acetamido-3-methylbutanoyl)pyrrolidine-2-carbonyl]amino] 2-hydroxy-4-methylpentanoate Traditional Name: 2-hydroxy-4-methyl-valeric acid [[1-(2-acetamido-3-methyl-butanoyl)prolyl]amino] ester Formula: C18H31N3O6 MolecularWeight: 385.45524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)ONC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C)O

Isomeric SMILES

CC(C)CC(C(=O)ONC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C)O

InChI

InChI=1S/C18H31N3O6/c1-10(2)9-14(23)18(26)27-20-16(24)13-7-6-8-21(13)17(25)15(11(3)4)19-12(5)22/h10-11,13-15,23H,6-9H2,1-5H3,(H,19,22)(H,20,24)