2-[[4-azanyl-2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxidanylidene-butanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-azanyl-2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxidanylidene-butanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-amino-2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxo-butanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[4-amino-2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1,4-dioxobutyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[4-amino-2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[4-amino-4-keto-2-(tyrosylamino)butanoyl]amino]-4-methyl-valeric acid Formula: C19H28N4O6 MolecularWeight: 408.44882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O6/c1-10(2)7-15(19(28)29)23-18(27)14(9-16(21)25)22-17(26)13(20)8-11-3-5-12(24)6-4-11/h3-6,10,13-15,24H,7-9,20H2,1-2H3,(H2,21,25)(H,22,26)(H,23,27)(H,28,29)