N-[(5-methylfuran-2-yl)methyl]-3-[(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-3-[(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: N-[(5-methyl-2-furyl)methyl]-3-[(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide CAS Name: N-[(5-methyl-2-furanyl)methyl]-3-[(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-[(5-methylfuran-2-yl)methyl]-3-[(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: N-[(5-methyl-2-furyl)methyl]-3-[(3R)-1-[(5-phenyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]propionamide Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)CCC2CCC[NH+](C2)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)CC[C@H]2CCC[NH+](C2)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H30N4O2/c1-18-9-11-22(30-18)15-25-23(29)12-10-19-6-5-13-28(16-19)17-21-14-26-27-24(21)20-7-3-2-4-8-20/h2-4,7-9,11,14,19H,5-6,10,12-13,15-17H2,1H3,(H,25,29)(H,26,27)/p+1/t19-/m1/s1