(2S)-3-methyl-2-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]butanoic acid CAS Name: (2S)-3-methyl-2-[[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]butanoic acid Traditional Name: (2S)-3-methyl-2-[(3-phenylanthranil-5-carbonyl)amino]butyric acid Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC2=C(ON=C2C=C1)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C1=CC2=C(ON=C2C=C1)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O4/c1-11(2)16(19(23)24)20-18(22)13-8-9-15-14(10-13)17(25-21-15)12-6-4-3-5-7-12/h3-11,16H,1-2H3,(H,20,22)(H,23,24)/t16-/m0/s1