3-(3-methoxyphenyl)-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-3H-1,2-benzoxazol-2-ium

Systemtic Name: 3-(3-methoxyphenyl)-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-3H-1,2-benzoxazol-2-ium Openeye Name: 3-(3-methoxyphenyl)-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-3H-1,2-benzoxazol-2-ium CAS Name: 3-(3-methoxyphenyl)-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-3H-1,2-benzoxazol-2-ium IUPAC Name: 3-(3-methoxyphenyl)-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-3H-1,2-benzoxazol-2-ium Traditional Name: 3-(3-methoxyphenyl)-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-3H-indoxazen-2-ium Formula: C16H24NO2+ MolecularWeight: 262.36726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(C2CCCCC2O1)C3=CC(=CC=C3)OC)C

Isomeric SMILES

C[N+]1(C(C2CCCCC2O1)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C16H24NO2/c1-17(2)16(12-7-6-8-13(11-12)18-3)14-9-4-5-10-15(14)19-17/h6-8,11,14-16H,4-5,9-10H2,1-3H3/q+1