3-[(3R)-1-[(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: 3-[(3R)-1-[(2-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide Openeye Name: 3-[(3R)-1-[(2-chloro-4-hydroxy-5-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide CAS Name: 3-[(3R)-1-[(2-chloro-4-hydroxy-5-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)propanamide IUPAC Name: 3-[(3R)-1-[(2-chloro-4-hydroxy-5-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propanamide Traditional Name: 3-[(3R)-1-(2-chloro-4-hydroxy-5-methoxy-benzyl)piperidin-1-ium-3-yl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)propionamide Formula: C23H38ClN3O3+2 MolecularWeight: 440.01912

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CCC2CCC[NH+](C2)CC3=CC(=C(C=C3Cl)O)OC

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)CC[C@H]2CCC[NH+](C2)CC3=CC(=C(C=C3Cl)O)OC

InChI

InChI=1S/C23H36ClN3O3/c1-25-11-8-19(9-12-25)26(2)23(29)7-6-17-5-4-10-27(15-17)16-18-13-22(30-3)21(28)14-20(18)24/h13-14,17,19,28H,4-12,15-16H2,1-3H3/p+2/t17-/m1/s1