8-(1-adamantyl)-6-methoxy-3-methyl-2H-1,3-benzoxazin-3-ium

Systemtic Name: 8-(1-adamantyl)-6-methoxy-3-methyl-2H-1,3-benzoxazin-3-ium Openeye Name: 8-(1-adamantyl)-6-methoxy-3-methyl-2H-1,3-benzoxazin-3-ium CAS Name: 8-(1-adamantyl)-6-methoxy-3-methyl-2H-1,3-benzoxazin-3-ium IUPAC Name: 8-(1-adamantyl)-6-methoxy-3-methyl-2H-1,3-benzoxazin-3-ium Traditional Name: 8-(1-adamantyl)-6-methoxy-3-methyl-2H-1,3-benzoxazin-3-ium Formula: C20H26NO2+ MolecularWeight: 312.42594

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC(=CC(=C2OC1)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

C[N+]1=CC2=CC(=CC(=C2OC1)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C20H26NO2/c1-21-11-16-6-17(22-2)7-18(19(16)23-12-21)20-8-13-3-14(9-20)5-15(4-13)10-20/h6-7,11,13-15H,3-5,8-10,12H2,1-2H3/q+1