(1S,2R)-1-(furan-2-yl)-2-phenyl-1-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]butan-1-ol

Systemtic Name: (1S,2R)-1-(furan-2-yl)-2-phenyl-1-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]butan-1-ol Openeye Name: (1S,2R)-1-(2-furyl)-2-phenyl-1-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]butan-1-ol CAS Name: (1S,2R)-1-(2-furanyl)-2-phenyl-1-[4-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]-1-butanol IUPAC Name: (1S,2R)-1-(furan-2-yl)-2-phenyl-1-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]butan-1-ol Traditional Name: (1S,2R)-1-(2-furyl)-2-phenyl-1-[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]butan-1-ol Formula: C26H32NO3+ MolecularWeight: 406.53718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(C2=CC=C(C=C2)OCC[NH+]3CCCC3)(C4=CC=CO4)O

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)[C@](C2=CC=C(C=C2)OCC[NH+]3CCCC3)(C4=CC=CO4)O

InChI

InChI=1S/C26H31NO3/c1-2-24(21-9-4-3-5-10-21)26(28,25-11-8-19-30-25)22-12-14-23(15-13-22)29-20-18-27-16-6-7-17-27/h3-5,8-15,19,24,28H,2,6-7,16-18,20H2,1H3/p+1/t24-,26-/m1/s1