[4-(1-adamantyl)piperazin-4-ium-1-yl]-(3,5-dimethyl-1,2-oxazol-4-yl)methanone

Systemtic Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(3,5-dimethyl-1,2-oxazol-4-yl)methanone Openeye Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(3,5-dimethylisoxazol-4-yl)methanone CAS Name: [4-(1-adamantyl)-1-piperazin-4-iumyl]-(3,5-dimethyl-4-isoxazolyl)methanone IUPAC Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(3,5-dimethyl-1,2-oxazol-4-yl)methanone Traditional Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(3,5-dimethylisoxazol-4-yl)methanone Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CC[NH+](CC2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CC[NH+](CC2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H29N3O2/c1-13-18(14(2)25-21-13)19(24)22-3-5-23(6-4-22)20-10-15-7-16(11-20)9-17(8-15)12-20/h15-17H,3-12H2,1-2H3/p+1