3-cyclopentyl-1-[4-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[2-(4-methoxyphenyl)-2-oxo-ethyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[2-(4-methoxyphenyl)-2-oxoethyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[2-(4-methoxyphenyl)-2-oxoethyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-[2-keto-2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]propan-1-one Formula: C21H31N2O3+ MolecularWeight: 359.48244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)CCC3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)CCC3CCCC3

InChI

InChI=1S/C21H30N2O3/c1-26-19-9-7-18(8-10-19)20(24)16-22-12-14-23(15-13-22)21(25)11-6-17-4-2-3-5-17/h7-10,17H,2-6,11-16H2,1H3/p+1