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

Systemtic Name: 3-(8-cyclohexyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl)propanoic acid Openeye Name: 3-(8-cyclohexyl-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid CAS Name: 3-(8-cyclohexyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl)propanoic acid IUPAC Name: 3-(8-cyclohexyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl)propanoic acid Traditional Name: 3-(8-cyclohexyl-2-isopropyl-3-keto-1,4-benzoxazin-4-yl)propionic acid Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=CC=CC(=C2O1)C3CCCCC3)CCC(=O)O

Isomeric SMILES

CC(C)C1C(=O)N(C2=CC=CC(=C2O1)C3CCCCC3)CCC(=O)O

InChI

InChI=1S/C20H27NO4/c1-13(2)18-20(24)21(12-11-17(22)23)16-10-6-9-15(19(16)25-18)14-7-4-3-5-8-14/h6,9-10,13-14,18H,3-5,7-8,11-12H2,1-2H3,(H,22,23)