N-[(1R,5S)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl]-N-phenethyl-benzamide

Systemtic Name: N-[(1R,5S)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl]-N-phenethyl-benzamide Openeye Name: N-[(1R,5S)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl]-N-phenethyl-benzamide CAS Name: N-[(1R,5S)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl]-N-phenethylbenzamide IUPAC Name: N-[(1R,5S)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl]-N-phenethylbenzamide Traditional Name: N-[(1R,5S)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-en-3-yl]-N-phenethyl-benzamide Formula: C23H27N2O+ MolecularWeight: 347.47328

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C2CCC1C=C(C2)N(CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1[C@@H]2CC[C@H]1C=C(C2)N(CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O/c1-24-20-12-13-21(24)17-22(16-20)25(15-14-18-8-4-2-5-9-18)23(26)19-10-6-3-7-11-19/h2-11,16,20-21H,12-15,17H2,1H3/p+1/t20-,21+/m0/s1