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

Systemtic Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-propoxyphenyl)methanone Openeye Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-propoxyphenyl)methanone CAS Name: (4-cyclohexyl-1-piperazin-4-iumyl)-(3-propoxyphenyl)methanone IUPAC Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-propoxyphenyl)methanone Traditional Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-propoxyphenyl)methanone Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)C3CCCCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)C3CCCCC3

InChI

InChI=1S/C20H30N2O2/c1-2-15-24-19-10-6-7-17(16-19)20(23)22-13-11-21(12-14-22)18-8-4-3-5-9-18/h6-7,10,16,18H,2-5,8-9,11-15H2,1H3/p+1