N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-N-methyl-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-5-phenyl-isoxazole-3-carboxamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=NOC(=C4)C5=CC=CC=C5

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=NOC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H27N3O2/c1-27(25(29)23-16-24(30-26-23)18-8-3-2-4-9-18)21-12-7-13-28(17-21)22-14-19-10-5-6-11-20(19)15-22/h2-6,8-11,16,21-22H,7,12-15,17H2,1H3/p+1/t21-/m0/s1