N-[(1R)-1-[1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-2-(3-methoxyphenyl)ethyl]-N-methyl-furan-2-carboxamide

Systemtic Name: N-[(1R)-1-[1-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-2-(3-methoxyphenyl)ethyl]-N-methyl-furan-2-carboxamide Openeye Name: N-[(1R)-1-[1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-2-(3-methoxyphenyl)ethyl]-N-methyl-furan-2-carboxamide CAS Name: N-[(1R)-1-[1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]-2-(3-methoxyphenyl)ethyl]-N-methyl-2-furancarboxamide IUPAC Name: N-[(1R)-1-[1-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-2-(3-methoxyphenyl)ethyl]-N-methylfuran-2-carboxamide Traditional Name: N-[(1R)-1-[1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-2-(3-methoxyphenyl)ethyl]-N-methyl-2-furamide Formula: C26H34ClN4O3+ MolecularWeight: 486.02616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH+]2CCC(CC2)C(CC3=CC(=CC=C3)OC)N(C)C(=O)C4=CC=CO4)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C[NH+]2CCC(CC2)[C@@H](CC3=CC(=CC=C3)OC)N(C)C(=O)C4=CC=CO4)Cl)C

InChI

InChI=1S/C26H33ClN4O3/c1-18-22(25(27)30(3)28-18)17-31-12-10-20(11-13-31)23(16-19-7-5-8-21(15-19)33-4)29(2)26(32)24-9-6-14-34-24/h5-9,14-15,20,23H,10-13,16-17H2,1-4H3/p+1/t23-/m1/s1