1-[4-(1-adamantyl)phenoxy]-3-(2,4,6-trimethylmorpholin-4-ium-4-yl)propan-2-ol

Systemtic Name: 1-[4-(1-adamantyl)phenoxy]-3-(2,4,6-trimethylmorpholin-4-ium-4-yl)propan-2-ol Openeye Name: 1-[4-(1-adamantyl)phenoxy]-3-(2,4,6-trimethylmorpholin-4-ium-4-yl)propan-2-ol CAS Name: 1-[4-(1-adamantyl)phenoxy]-3-(2,4,6-trimethyl-4-morpholin-4-iumyl)-2-propanol IUPAC Name: 1-[4-(1-adamantyl)phenoxy]-3-(2,4,6-trimethylmorpholin-4-ium-4-yl)propan-2-ol Traditional Name: 1-[4-(1-adamantyl)phenoxy]-3-(2,4,6-trimethylmorpholin-4-ium-4-yl)propan-2-ol Formula: C26H40NO3+ MolecularWeight: 414.6007

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[N+](CC(O1)C)(C)CC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CC1C[N+](CC(O1)C)(C)CC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C26H40NO3/c1-18-14-27(3,15-19(2)30-18)16-24(28)17-29-25-6-4-23(5-7-25)26-11-20-8-21(12-26)10-22(9-20)13-26/h4-7,18-22,24,28H,8-17H2,1-3H3/q+1