2-[2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-4-methyl-pentanoyl]amino]propanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-4-methyl-pentanoyl]amino]propanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[2-[[2-[(2-amino-3-methyl-butanoyl)amino]-4-methyl-pentanoyl]amino]propanoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[2-[(2-amino-3-methyl-1-oxobutyl)amino]-4-methyl-1-oxopentyl]amino]-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[2-[[2-[(2-amino-3-methylbutanoyl)amino]-4-methylpentanoyl]amino]propanoylamino]-3-phenylpropanoic acid Traditional Name: 2-[2-[[2-[(2-amino-3-methyl-butanoyl)amino]-4-methyl-pentanoyl]amino]propanoylamino]-3-phenyl-propionic acid Formula: C23H36N4O5 MolecularWeight: 448.55574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O5/c1-13(2)11-17(26-22(30)19(24)14(3)4)21(29)25-15(5)20(28)27-18(23(31)32)12-16-9-7-6-8-10-16/h6-10,13-15,17-19H,11-12,24H2,1-5H3,(H,25,29)(H,26,30)(H,27,28)(H,31,32)