(3-methylfuran-2-yl)-[4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-yl]methanone

Systemtic Name: (3-methylfuran-2-yl)-[4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-yl]methanone Openeye Name: (3-methyl-2-furyl)-[4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]-1-piperidyl]methanone CAS Name: (3-methyl-2-furanyl)-[4-[(3R)-1-phenethyl-3-pyrrolidin-1-iumyl]-1-piperidinyl]methanone IUPAC Name: (3-methylfuran-2-yl)-[4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidin-1-yl]methanone Traditional Name: (3-methyl-2-furyl)-[4-[(3R)-1-phenethylpyrrolidin-1-ium-3-yl]piperidino]methanone Formula: C23H31N2O2+ MolecularWeight: 367.50444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC=C1)C(=O)N2CCC(CC2)C3CC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC=C1)C(=O)N2CCC(CC2)[C@H]3CC[NH+](C3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H30N2O2/c1-18-11-16-27-22(18)23(26)25-14-9-20(10-15-25)21-8-13-24(17-21)12-7-19-5-3-2-4-6-19/h2-6,11,16,20-21H,7-10,12-15,17H2,1H3/p+1/t21-/m0/s1