3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(3-chloranyl-4-methoxy-phenyl)propanamide

Systemtic Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(3-chloranyl-4-methoxy-phenyl)propanamide Openeye Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(3-chloro-4-methoxy-phenyl)propanamide CAS Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]-3-piperidin-1-iumyl]-N-(3-chloro-4-methoxyphenyl)propanamide IUPAC Name: 3-[(3R)-1-[(4-acetamidophenyl)methyl]piperidin-1-ium-3-yl]-N-(3-chloro-4-methoxyphenyl)propanamide Traditional Name: 3-[(3R)-1-(4-acetamidobenzyl)piperidin-1-ium-3-yl]-N-(3-chloro-4-methoxy-phenyl)propionamide Formula: C24H31ClN3O3+ MolecularWeight: 444.97424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCCC(C2)CCC(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCC[C@@H](C2)CCC(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C24H30ClN3O3/c1-17(29)26-20-8-5-19(6-9-20)16-28-13-3-4-18(15-28)7-12-24(30)27-21-10-11-23(31-2)22(25)14-21/h5-6,8-11,14,18H,3-4,7,12-13,15-16H2,1-2H3,(H,26,29)(H,27,30)/p+1/t18-/m1/s1