(3-methylpyridin-2-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone

Systemtic Name: (3-methylpyridin-2-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone Openeye Name: (3-methyl-2-pyridyl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone CAS Name: (3-methyl-2-pyridinyl)-[(3R)-3-(1-phenethyl-4-piperidin-1-iumyl)-1-pyrrolidinyl]methanone IUPAC Name: (3-methylpyridin-2-yl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone Traditional Name: (3-methyl-2-pyridyl)-[(3R)-3-(1-phenethylpiperidin-1-ium-4-yl)pyrrolidino]methanone Formula: C24H32N3O+ MolecularWeight: 378.53038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(=O)N2CCC(C2)C3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=CC=C1)C(=O)N2CC[C@@H](C2)C3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H31N3O/c1-19-6-5-13-25-23(19)24(28)27-17-12-22(18-27)21-10-15-26(16-11-21)14-9-20-7-3-2-4-8-20/h2-8,13,21-22H,9-12,14-18H2,1H3/p+1/t22-/m0/s1