2-[[2-[2-[(4-methoxyphenyl)carbonylamino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-[2-[(4-methoxyphenyl)carbonylamino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[[2-[(4-methoxybenzoyl)amino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[[(4-methoxyphenyl)-oxomethyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[[2-[(4-methoxybenzoyl)amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid Traditional Name: 4-methyl-2-[[2-[[2-(p-anisoylamino)acetyl]amino]-3-phenyl-propanoyl]amino]valeric acid Formula: C25H31N3O6 MolecularWeight: 469.53014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C25H31N3O6/c1-16(2)13-21(25(32)33)28-24(31)20(14-17-7-5-4-6-8-17)27-22(29)15-26-23(30)18-9-11-19(34-3)12-10-18/h4-12,16,20-21H,13-15H2,1-3H3,(H,26,30)(H,27,29)(H,28,31)(H,32,33)