(4-cyclohexylpiperazin-4-ium-1-yl)-(3-methylphenyl)methanone

Systemtic Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-methylphenyl)methanone Openeye Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(m-tolyl)methanone CAS Name: (4-cyclohexyl-1-piperazin-4-iumyl)-(3-methylphenyl)methanone IUPAC Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-methylphenyl)methanone Traditional Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(m-tolyl)methanone Formula: C18H27N2O+ MolecularWeight: 287.41978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)C3CCCCC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)C3CCCCC3

InChI

InChI=1S/C18H26N2O/c1-15-6-5-7-16(14-15)18(21)20-12-10-19(11-13-20)17-8-3-2-4-9-17/h5-7,14,17H,2-4,8-13H2,1H3/p+1