(2S)-N-(1-adamantyl)-2-piperazin-1-ium-1-yl-propanamide

Systemtic Name: (2S)-N-(1-adamantyl)-2-piperazin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(1-adamantyl)-2-piperazin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(1-adamantyl)-2-(1-piperazin-1-iumyl)propanamide IUPAC Name: (2S)-N-(1-adamantyl)-2-piperazin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(1-adamantyl)-2-piperazin-1-ium-1-yl-propionamide Formula: C17H30N3O+ MolecularWeight: 292.4396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)[NH+]4CCNCC4

Isomeric SMILES

C[C@@H](C(=O)NC12CC3CC(C1)CC(C3)C2)[NH+]4CCNCC4

InChI

InChI=1S/C17H29N3O/c1-12(20-4-2-18-3-5-20)16(21)19-17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15,18H,2-11H2,1H3,(H,19,21)/p+1/t12-,13?,14?,15?,17?/m0/s1