N-[(1R)-1-(1-adamantyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[4-(dimethylamino)-1-pyridin-1-iumyl]acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Formula: C21H32N3O+ MolecularWeight: 342.49828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C[N+]4=CC=C(C=C4)N(C)C

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)C[N+]4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C21H31N3O/c1-15(21-11-16-8-17(12-21)10-18(9-16)13-21)22-20(25)14-24-6-4-19(5-7-24)23(2)3/h4-7,15-18H,8-14H2,1-3H3/p+1/t15-,16?,17?,18?,21?/m1/s1