4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[phenyl-(phenylmethyl)amino]propan-2-yl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[phenyl-(phenylmethyl)amino]propan-2-yl]amino]pentanoic acid Openeye Name: 2-[[1-[(N-benzylanilino)methyl]-2-hydroxy-2-oxo-ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[1-hydroxy-1-oxo-3-(N-(phenylmethyl)anilino)propan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[3-(N-benzylanilino)-1-hydroxy-1-oxopropan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[1-[(N-benzylanilino)methyl]-2-hydroxy-2-keto-ethyl]amino]-4-methyl-valeric acid Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CN(CC1=CC=CC=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(CN(CC1=CC=CC=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H28N2O4/c1-16(2)13-19(21(25)26)23-20(22(27)28)15-24(18-11-7-4-8-12-18)14-17-9-5-3-6-10-17/h3-12,16,19-20,23H,13-15H2,1-2H3,(H,25,26)(H,27,28)