[(3R)-1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3R)-1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3R)-1-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3R)-1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3R)-1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3R)-1-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperidin-1-ium-3-yl]methanol Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)[NH+]2CCCC(C2)CO

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)OC)[NH+]2CCC[C@H](C2)CO

InChI

InChI=1S/C17H27NO2/c1-14(18-11-3-4-16(12-18)13-19)5-6-15-7-9-17(20-2)10-8-15/h7-10,14,16,19H,3-6,11-13H2,1-2H3/p+1/t14-,16+/m0/s1