N-cyclohexyl-N-methyl-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-cyclohexyl-N-methyl-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: N-cyclohexyl-N-methyl-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]propanamide CAS Name: N-cyclohexyl-N-methyl-3-[(3S,4R)-4-(4-morpholin-4-iumyl)-1-(2-pyridinylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclohexyl-N-methyl-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide Traditional Name: N-cyclohexyl-N-methyl-3-[(3S,4R)-4-morpholin-4-ium-4-yl-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]propionamide Formula: C25H42N4O2+2 MolecularWeight: 430.62658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CCC2C[NH+](CCC2[NH+]3CCOCC3)CC4=CC=CC=N4

Isomeric SMILES

CN(C1CCCCC1)C(=O)CC[C@H]2C[NH+](CC[C@H]2[NH+]3CCOCC3)CC4=CC=CC=N4

InChI

InChI=1S/C25H40N4O2/c1-27(23-8-3-2-4-9-23)25(30)11-10-21-19-28(20-22-7-5-6-13-26-22)14-12-24(21)29-15-17-31-18-16-29/h5-7,13,21,23-24H,2-4,8-12,14-20H2,1H3/p+2/t21-,24+/m0/s1