(3,5-dimethylphenyl)-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3,5-dimethylphenyl)-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: (3,5-dimethylphenyl)-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: (3,5-dimethylphenyl)-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3,5-dimethylphenyl)-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: (3,5-dimethylphenyl)-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CC(=CC(=C2)C)C

InChI

InChI=1S/C16H24N2O/c1-4-5-17-6-8-18(9-7-17)16(19)15-11-13(2)10-14(3)12-15/h10-12H,4-9H2,1-3H3/p+1