(2S)-1-cyclopentyloxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-cyclopentyloxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Openeye Name: (2S)-1-(cyclopentoxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-cyclopentyloxy-3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2-propanol IUPAC Name: (2S)-1-cyclopentyloxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Traditional Name: (2S)-1-(cyclopentoxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C19H31N2O3+ MolecularWeight: 335.46104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC(COC3CCCC3)O

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C[C@@H](COC3CCCC3)O

InChI

InChI=1S/C19H30N2O3/c1-23-19-9-5-4-8-18(19)21-12-10-20(11-13-21)14-16(22)15-24-17-6-2-3-7-17/h4-5,8-9,16-17,22H,2-3,6-7,10-15H2,1H3/p+1/t16-/m0/s1