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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O5/c1-13(2)11-17(24)21(29)25-15(5)20(28)27-19(14(3)4)22(30)26-18(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)