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

Systemtic Name: 3-(8-tert-butyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl)propanoic acid Openeye Name: 3-(8-tert-butyl-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid CAS Name: 3-(8-tert-butyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl)propanoic acid IUPAC Name: 3-(8-tert-butyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl)propanoic acid Traditional Name: 3-(8-tert-butyl-2-isopropyl-3-keto-1,4-benzoxazin-4-yl)propionic acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=CC=CC(=C2O1)C(C)(C)C)CCC(=O)O

Isomeric SMILES

CC(C)C1C(=O)N(C2=CC=CC(=C2O1)C(C)(C)C)CCC(=O)O

InChI

InChI=1S/C18H25NO4/c1-11(2)15-17(22)19(10-9-14(20)21)13-8-6-7-12(16(13)23-15)18(3,4)5/h6-8,11,15H,9-10H2,1-5H3,(H,20,21)