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

Systemtic Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-ethoxyphenyl)methanone Openeye Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-ethoxyphenyl)methanone CAS Name: (4-cyclohexyl-1-piperazin-4-iumyl)-(3-ethoxyphenyl)methanone IUPAC Name: (4-cyclohexylpiperazin-4-ium-1-yl)-(3-ethoxyphenyl)methanone Traditional Name: (4-cyclohexylpiperazin-4-ium-1-yl)-m-phenetyl-methanone Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)C3CCCCC3

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)C3CCCCC3

InChI

InChI=1S/C19H28N2O2/c1-2-23-18-10-6-7-16(15-18)19(22)21-13-11-20(12-14-21)17-8-4-3-5-9-17/h6-7,10,15,17H,2-5,8-9,11-14H2,1H3/p+1