3-(8-tert-butyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)propanoic acid

Systemtic Name: 3-(8-tert-butyl-3-oxidanylidene-2-phenyl-1,4-benzoxazin-4-yl)propanoic acid Openeye Name: 3-(8-tert-butyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl)propanoic acid CAS Name: 3-(8-tert-butyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl)propanoic acid IUPAC Name: 3-(8-tert-butyl-3-oxo-2-phenyl-1,4-benzoxazin-4-yl)propanoic acid Traditional Name: 3-(8-tert-butyl-3-keto-2-phenyl-1,4-benzoxazin-4-yl)propionic acid Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=CC=C1)N(C(=O)C(O2)C3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=C2C(=CC=C1)N(C(=O)C(O2)C3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C21H23NO4/c1-21(2,3)15-10-7-11-16-19(15)26-18(14-8-5-4-6-9-14)20(25)22(16)13-12-17(23)24/h4-11,18H,12-13H2,1-3H3,(H,23,24)