N,1-dimethyl-N-[(1R)-1-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyrazole-3-carboxamide

Systemtic Name: N,1-dimethyl-N-[(1R)-1-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyrazole-3-carboxamide Openeye Name: N,1-dimethyl-N-[(1R)-1-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyrazole-3-carboxamide CAS Name: N,1-dimethyl-N-[(1R)-1-[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-3-pyrazolecarboxamide IUPAC Name: N,1-dimethyl-N-[(1R)-1-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]-2-phenylethyl]pyrazole-3-carboxamide Traditional Name: N,1-dimethyl-N-[(1R)-1-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyrazole-3-carboxamide Formula: C25H33N4O2+ MolecularWeight: 421.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(CC3=CC=CC=C3)N(C)C(=O)C4=NN(C=C4)C

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)[C@@H](CC3=CC=CC=C3)N(C)C(=O)C4=NN(C=C4)C

InChI

InChI=1S/C25H32N4O2/c1-19-9-10-22(31-19)18-29-15-11-21(12-16-29)24(17-20-7-5-4-6-8-20)28(3)25(30)23-13-14-27(2)26-23/h4-10,13-14,21,24H,11-12,15-18H2,1-3H3/p+1/t24-/m1/s1