(2S)-1-[4-[(1S)-cyclopent-2-en-1-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-[4-[(1S)-cyclopent-2-en-1-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-[4-[(1S)-cyclopent-2-en-1-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-[4-[(1S)-1-cyclopent-2-enyl]phenoxy]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-[4-[(1S)-cyclopent-2-en-1-yl]phenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-[4-[(1S)-cyclopent-2-en-1-yl]phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C19H28NO2+ MolecularWeight: 302.43112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(COC2=CC=C(C=C2)C3CCC=C3)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](COC2=CC=C(C=C2)[C@H]3CCC=C3)O

InChI

InChI=1S/C19H27NO2/c21-18(14-20-12-4-1-5-13-20)15-22-19-10-8-17(9-11-19)16-6-2-3-7-16/h2,6,8-11,16,18,21H,1,3-5,7,12-15H2/p+1/t16-,18+/m1/s1