(2S,3S,4S,6R)-2,6-bis(4-methoxyphenyl)-3-methyl-piperidin-1-ium-4-ol

Systemtic Name: (2S,3S,4S,6R)-2,6-bis(4-methoxyphenyl)-3-methyl-piperidin-1-ium-4-ol Openeye Name: (2S,3S,4S,6R)-2,6-bis(4-methoxyphenyl)-3-methyl-piperidin-1-ium-4-ol CAS Name: (2S,3S,4S,6R)-2,6-bis(4-methoxyphenyl)-3-methyl-4-piperidin-1-iumol IUPAC Name: (2S,3S,4S,6R)-2,6-bis(4-methoxyphenyl)-3-methylpiperidin-1-ium-4-ol Traditional Name: (2S,3S,4S,6R)-2,6-bis(4-methoxyphenyl)-3-methyl-piperidin-1-ium-4-ol Formula: C20H26NO3+ MolecularWeight: 328.42534

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC([NH2+]C1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)O

Isomeric SMILES

C[C@@H]1[C@H](C[C@@H]([NH2+][C@@H]1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C20H25NO3/c1-13-19(22)12-18(14-4-8-16(23-2)9-5-14)21-20(13)15-6-10-17(24-3)11-7-15/h4-11,13,18-22H,12H2,1-3H3/p+1/t13-,18-,19+,20+/m1/s1