2-[[3-methyl-3-(phenylmethyl)-3-azoniabicyclo[3.2.1]octan-8-yl]methyl]-2-phenyl-butanamide

Systemtic Name: 2-[[3-methyl-3-(phenylmethyl)-3-azoniabicyclo[3.2.1]octan-8-yl]methyl]-2-phenyl-butanamide Openeye Name: 2-[(3-benzyl-3-methyl-3-azoniabicyclo[3.2.1]octan-8-yl)methyl]-2-phenyl-butanamide CAS Name: 2-[[3-methyl-3-(phenylmethyl)-3-azoniabicyclo[3.2.1]octan-8-yl]methyl]-2-phenylbutanamide IUPAC Name: 2-[(3-benzyl-3-methyl-3-azoniabicyclo[3.2.1]octan-8-yl)methyl]-2-phenylbutanamide Traditional Name: 2-[(3-benzyl-3-methyl-3-azoniabicyclo[3.2.1]octan-8-yl)methyl]-2-phenyl-butyramide Formula: C26H35N2O+ MolecularWeight: 391.5689

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1C2CCC1C[N+](C2)(C)CC3=CC=CC=C3)(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

CCC(CC1C2CCC1C[N+](C2)(C)CC3=CC=CC=C3)(C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C26H34N2O/c1-3-26(25(27)29,23-12-8-5-9-13-23)16-24-21-14-15-22(24)19-28(2,18-21)17-20-10-6-4-7-11-20/h4-13,21-22,24H,3,14-19H2,1-2H3,(H-,27,29)/p+1