N-(3-methylbutyl)-3-piperazin-4-ium-1-yl-propanamide

Systemtic Name: N-(3-methylbutyl)-3-piperazin-4-ium-1-yl-propanamide Openeye Name: N-isopentyl-3-piperazin-4-ium-1-yl-propanamide CAS Name: N-(3-methylbutyl)-3-(1-piperazin-4-iumyl)propanamide IUPAC Name: N-(3-methylbutyl)-3-piperazin-4-ium-1-ylpropanamide Traditional Name: N-isoamyl-3-piperazin-4-ium-1-yl-propionamide Formula: C12H26N3O+ MolecularWeight: 228.35434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CCN1CC[NH2+]CC1

Isomeric SMILES

CC(C)CCNC(=O)CCN1CC[NH2+]CC1

InChI

InChI=1S/C12H25N3O/c1-11(2)3-5-14-12(16)4-8-15-9-6-13-7-10-15/h11,13H,3-10H2,1-2H3,(H,14,16)/p+1