2-[[2-[(2-acetamido-3-phenyl-propanoyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[(2-acetamido-3-phenyl-propanoyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[(2-acetamido-3-phenyl-propanoyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[(2-acetamido-1-oxo-3-phenylpropyl)amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[(2-acetamido-3-phenylpropanoyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[(2-acetamido-3-phenyl-propanoyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methyl-valeric acid Formula: C23H31N5O5 MolecularWeight: 457.52274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CC1=CN=CN1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(CC1=CN=CN1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C23H31N5O5/c1-14(2)9-20(23(32)33)28-22(31)19(11-17-12-24-13-25-17)27-21(30)18(26-15(3)29)10-16-7-5-4-6-8-16/h4-8,12-14,18-20H,9-11H2,1-3H3,(H,24,25)(H,26,29)(H,27,30)(H,28,31)(H,32,33)