N-[(2R)-3-oxidanyl-3-prop-2-enyl-hex-5-en-2-yl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-[(2R)-3-oxidanyl-3-prop-2-enyl-hex-5-en-2-yl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-[(1R)-2-allyl-2-hydroxy-1-methyl-pent-4-enyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-[(2R)-3-hydroxy-3-prop-2-enylhex-5-en-2-yl]-4-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[(2R)-3-hydroxy-3-prop-2-enylhex-5-en-2-yl]-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-[(1R)-2-allyl-2-hydroxy-1-methyl-pent-4-enyl]-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C27H36N3O3+ MolecularWeight: 450.59304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC=C)(CC=C)O)NC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

C[C@H](C(CC=C)(CC=C)O)NC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C27H35N3O3/c1-4-15-27(32,16-5-2)21(3)29-26(31)22-9-11-24(12-10-22)33-25-13-18-30(19-14-25)20-23-8-6-7-17-28-23/h4-12,17,21,25,32H,1-2,13-16,18-20H2,3H3,(H,29,31)/p+1/t21-/m1/s1