2-[[2,7-dimethyl-5-[(2-naphthalen-1-yl-2-oxidanyl-ethanoyl)amino]-4-oxidanyl-octanoyl]amino]propanoic acid

Systemtic Name: 2-[[2,7-dimethyl-5-[(2-naphthalen-1-yl-2-oxidanyl-ethanoyl)amino]-4-oxidanyl-octanoyl]amino]propanoic acid Openeye Name: 2-[[4-hydroxy-5-[[2-hydroxy-2-(1-naphthyl)acetyl]amino]-2,7-dimethyl-octanoyl]amino]propanoic acid CAS Name: 2-[[4-hydroxy-5-[[2-hydroxy-2-(1-naphthalenyl)-1-oxoethyl]amino]-2,7-dimethyl-1-oxooctyl]amino]propanoic acid IUPAC Name: 2-[[4-hydroxy-5-[(2-hydroxy-2-naphthalen-1-ylacetyl)amino]-2,7-dimethyloctanoyl]amino]propanoic acid Traditional Name: 2-[[4-hydroxy-5-[[2-hydroxy-2-(1-naphthyl)acetyl]amino]-2,7-dimethyl-octanoyl]amino]propionic acid Formula: C25H34N2O6 MolecularWeight: 458.54726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC(C)C(=O)NC(C)C(=O)O)O)NC(=O)C(C1=CC=CC2=CC=CC=C21)O

Isomeric SMILES

CC(C)CC(C(CC(C)C(=O)NC(C)C(=O)O)O)NC(=O)C(C1=CC=CC2=CC=CC=C21)O

InChI

InChI=1S/C25H34N2O6/c1-14(2)12-20(21(28)13-15(3)23(30)26-16(4)25(32)33)27-24(31)22(29)19-11-7-9-17-8-5-6-10-18(17)19/h5-11,14-16,20-22,28-29H,12-13H2,1-4H3,(H,26,30)(H,27,31)(H,32,33)