3-methyl-N-[2-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide

Systemtic Name: 3-methyl-N-[2-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Openeye Name: 3-methyl-N-[2-[1-[(3R)-3-(5-methyl-2-furyl)butyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide CAS Name: 3-methyl-N-[2-[1-[(3R)-3-(5-methyl-2-furanyl)butyl]-4-piperidin-1-iumyl]-3-pyrazolyl]butanamide IUPAC Name: 3-methyl-N-[2-[1-[(3R)-3-(5-methylfuran-2-yl)butyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Traditional Name: 3-methyl-N-[2-[1-[(3R)-3-(5-methyl-2-furyl)butyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butyramide Formula: C22H35N4O2+ MolecularWeight: 387.5389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)CC[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC(C)C

Isomeric SMILES

CC1=CC=C(O1)[C@H](C)CC[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC(C)C

InChI

InChI=1S/C22H34N4O2/c1-16(2)15-22(27)24-21-7-11-23-26(21)19-9-13-25(14-10-19)12-8-17(3)20-6-5-18(4)28-20/h5-7,11,16-17,19H,8-10,12-15H2,1-4H3,(H,24,27)/p+1/t17-/m1/s1