2-methyl-2-[[1-[(3-pyrrol-1-ylphenyl)methoxy]naphthalen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 2-methyl-2-[[1-[(3-pyrrol-1-ylphenyl)methoxy]naphthalen-2-yl]carbonylamino]propanoic acid Openeye Name: 2-methyl-2-[[1-[(3-pyrrol-1-ylphenyl)methoxy]naphthalene-2-carbonyl]amino]propanoic acid CAS Name: 2-methyl-2-[[oxo-[1-[[3-(1-pyrrolyl)phenyl]methoxy]-2-naphthalenyl]methyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[[1-[(3-pyrrol-1-ylphenyl)methoxy]naphthalene-2-carbonyl]amino]propanoic acid Traditional Name: 2-methyl-2-[[1-(3-pyrrol-1-ylbenzyl)oxy-2-naphthoyl]amino]propionic acid Formula: C26H24N2O4 MolecularWeight: 428.47976

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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(=CC=C3)N4C=CC=C4

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C26H24N2O4/c1-26(2,25(30)31)27-24(29)22-13-12-19-9-3-4-11-21(19)23(22)32-17-18-8-7-10-20(16-18)28-14-5-6-15-28/h3-16H,17H2,1-2H3,(H,27,29)(H,30,31)