[4-butyl-4-(phenylmethyl)piperazin-4-ium-1-yl]-(2,3-dimethylphenyl)methanone

Systemtic Name: [4-butyl-4-(phenylmethyl)piperazin-4-ium-1-yl]-(2,3-dimethylphenyl)methanone Openeye Name: (4-benzyl-4-butyl-piperazin-4-ium-1-yl)-(2,3-dimethylphenyl)methanone CAS Name: [4-butyl-4-(phenylmethyl)-1-piperazin-4-iumyl]-(2,3-dimethylphenyl)methanone IUPAC Name: (4-benzyl-4-butylpiperazin-4-ium-1-yl)-(2,3-dimethylphenyl)methanone Traditional Name: (4-benzyl-4-butyl-piperazin-4-ium-1-yl)-(2,3-dimethylphenyl)methanone Formula: C24H33N2O+ MolecularWeight: 365.53162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCN(CC1)C(=O)C2=C(C(=CC=C2)C)C)CC3=CC=CC=C3

Isomeric SMILES

CCCC[N+]1(CCN(CC1)C(=O)C2=C(C(=CC=C2)C)C)CC3=CC=CC=C3

InChI

InChI=1S/C24H33N2O/c1-4-5-16-26(19-22-11-7-6-8-12-22)17-14-25(15-18-26)24(27)23-13-9-10-20(2)21(23)3/h6-13H,4-5,14-19H2,1-3H3/q+1