2-methyl-2-[[1-[(4-pyrazol-1-ylphenyl)methoxy]naphthalen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 2-methyl-2-[[1-[(4-pyrazol-1-ylphenyl)methoxy]naphthalen-2-yl]carbonylamino]propanoic acid Openeye Name: 2-methyl-2-[[1-[(4-pyrazol-1-ylphenyl)methoxy]naphthalene-2-carbonyl]amino]propanoic acid CAS Name: 2-methyl-2-[[oxo-[1-[[4-(1-pyrazolyl)phenyl]methoxy]-2-naphthalenyl]methyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[[1-[(4-pyrazol-1-ylphenyl)methoxy]naphthalene-2-carbonyl]amino]propanoic acid Traditional Name: 2-methyl-2-[[1-(4-pyrazol-1-ylbenzyl)oxy-2-naphthoyl]amino]propionic acid Formula: C25H23N3O4 MolecularWeight: 429.46782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C25H23N3O4/c1-25(2,24(30)31)27-23(29)21-13-10-18-6-3-4-7-20(18)22(21)32-16-17-8-11-19(12-9-17)28-15-5-14-26-28/h3-15H,16H2,1-2H3,(H,27,29)(H,30,31)