(2S,5R)-2,5-dimethyl-1-prop-2-enyl-piperazin-4-ium

Systemtic Name: (2S,5R)-2,5-dimethyl-1-prop-2-enyl-piperazin-4-ium Openeye Name: (2S,5R)-1-allyl-2,5-dimethyl-piperazin-4-ium CAS Name: (2S,5R)-2,5-dimethyl-1-prop-2-enylpiperazin-4-ium IUPAC Name: (2S,5R)-2,5-dimethyl-1-prop-2-enylpiperazin-4-ium Traditional Name: (2S,5R)-1-allyl-2,5-dimethyl-piperazin-4-ium Formula: C9H19N2+ MolecularWeight: 155.26056

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH2+]C(CN1CC=C)C

Isomeric SMILES

C[C@H]1C[NH2+][C@@H](CN1CC=C)C

InChI

InChI=1S/C9H18N2/c1-4-5-11-7-8(2)10-6-9(11)3/h4,8-10H,1,5-7H2,2-3H3/p+1/t8-,9+/m1/s1