3-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 3-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 3-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 3-[1-[(2R)-2,6-dimethylhept-5-enyl]-4-piperidin-1-iumyl]-1-(4-ethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 3-[1-[(2R)-2,6-dimethylhept-5-enyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Formula: C23H45N3O+2 MolecularWeight: 379.6229

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2CC[NH+](CC2)CC(C)CCC=C(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2CC[NH+](CC2)C[C@H](C)CCC=C(C)C

InChI

InChI=1S/C23H43N3O/c1-5-24-15-17-26(18-16-24)23(27)10-9-22-11-13-25(14-12-22)19-21(4)8-6-7-20(2)3/h7,21-22H,5-6,8-19H2,1-4H3/p+2/t21-/m1/s1