1-[(2R)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(2R)-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-2-oxidanyl-propyl]piperidin-1-ium-4-ol Openeye Name: 1-[(2R)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]piperidin-1-ium-4-ol CAS Name: 1-[(2R)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]-4-piperidin-1-iumol IUPAC Name: 1-[(2R)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]piperidin-1-ium-4-ol Traditional Name: 1-[(2R)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]piperidin-1-ium-4-ol Formula: C18H28NO4+ MolecularWeight: 322.41922

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OCC(C[NH+]2CCC(CC2)O)O)OC

Isomeric SMILES

C/C=C/C1=CC(=C(C=C1)OC[C@@H](C[NH+]2CCC(CC2)O)O)OC

InChI

InChI=1S/C18H27NO4/c1-3-4-14-5-6-17(18(11-14)22-2)23-13-16(21)12-19-9-7-15(20)8-10-19/h3-6,11,15-16,20-21H,7-10,12-13H2,1-2H3/p+1/b4-3+/t16-/m1/s1