(3S)-3-(4-methoxyphenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-ol

Systemtic Name: (3S)-3-(4-methoxyphenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-ol Openeye Name: (3S)-3-(4-methoxyphenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-ol CAS Name: (3S)-3-(4-methoxyphenyl)-5-(1-piperidin-1-iumyl)-1-penten-3-ol IUPAC Name: (3S)-3-(4-methoxyphenyl)-5-piperidin-1-ium-1-ylpent-1-en-3-ol Traditional Name: (3S)-3-(4-methoxyphenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-ol Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC[NH+]2CCCCC2)(C=C)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@](CC[NH+]2CCCCC2)(C=C)O

InChI

InChI=1S/C17H25NO2/c1-3-17(19,11-14-18-12-5-4-6-13-18)15-7-9-16(20-2)10-8-15/h3,7-10,19H,1,4-6,11-14H2,2H3/p+1/t17-/m1/s1