1-[6-[4-(1-methylpiperidin-1-ium-1-yl)phenoxy]-4-oxidanyl-heptyl]piperidin-3-ol

Systemtic Name: 1-[6-[4-(1-methylpiperidin-1-ium-1-yl)phenoxy]-4-oxidanyl-heptyl]piperidin-3-ol Openeye Name: 1-[4-hydroxy-6-[4-(1-methylpiperidin-1-ium-1-yl)phenoxy]heptyl]piperidin-3-ol CAS Name: 1-[4-hydroxy-6-[4-(1-methyl-1-piperidin-1-iumyl)phenoxy]heptyl]-3-piperidinol IUPAC Name: 1-[4-hydroxy-6-[4-(1-methylpiperidin-1-ium-1-yl)phenoxy]heptyl]piperidin-3-ol Traditional Name: 1-[4-hydroxy-6-[4-(1-methylpiperidin-1-ium-1-yl)phenoxy]heptyl]piperidin-3-ol Formula: C24H41N2O3+ MolecularWeight: 405.59394

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CCCN1CCCC(C1)O)O)OC2=CC=C(C=C2)[N+]3(CCCCC3)C

Isomeric SMILES

CC(CC(CCCN1CCCC(C1)O)O)OC2=CC=C(C=C2)[N+]3(CCCCC3)C

InChI

InChI=1S/C24H41N2O3/c1-20(18-22(27)8-6-14-25-15-7-9-23(28)19-25)29-24-12-10-21(11-13-24)26(2)16-4-3-5-17-26/h10-13,20,22-23,27-28H,3-9,14-19H2,1-2H3/q+1