2-[[3-azanyl-4-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-butanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3-azanyl-4-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-butanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[3-amino-4-(3,4-dihydroxyphenyl)-2-hydroxy-butanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[3-amino-4-(3,4-dihydroxyphenyl)-2-hydroxy-1-oxobutyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[3-amino-4-(3,4-dihydroxyphenyl)-2-hydroxybutanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[3-amino-4-(3,4-dihydroxyphenyl)-2-hydroxy-butanoyl]amino]-4-methyl-valeric acid Formula: C16H24N2O6 MolecularWeight: 340.37156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC(=C(C=C1)O)O)N)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC(=C(C=C1)O)O)N)O

InChI

InChI=1S/C16H24N2O6/c1-8(2)5-11(16(23)24)18-15(22)14(21)10(17)6-9-3-4-12(19)13(20)7-9/h3-4,7-8,10-11,14,19-21H,5-6,17H2,1-2H3,(H,18,22)(H,23,24)