3-(6-bromanyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-3-yl)propanoic acid

Systemtic Name: 3-(6-bromanyl-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-3-yl)propanoic acid Openeye Name: 3-(6-bromo-2-oxo-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-3-yl)propanoic acid CAS Name: 3-(6-bromo-2-oxo-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-3-yl)propanoic acid IUPAC Name: 3-(6-bromo-2-oxo-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-3-yl)propanoic acid Traditional Name: 3-(6-bromo-2-keto-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazol-3-yl)propionic acid Formula: C10H14BrNO4 MolecularWeight: 292.12646

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC1Br)OC(=O)N2CCC(=O)O

Isomeric SMILES

C1CC2C(CC1Br)OC(=O)N2CCC(=O)O

InChI

InChI=1S/C10H14BrNO4/c11-6-1-2-7-8(5-6)16-10(15)12(7)4-3-9(13)14/h6-8H,1-5H2,(H,13,14)