N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-(2,3-dimethylphenyl)-6-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-(2,3-dimethylphenyl)-6-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-N-(2,3-dimethylphenyl)-6-pyrrolidin-1-yl-pyridin-1-ium-3-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-(1-pyrrolidinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-(2,3-dimethylphenyl)-6-pyrrolidin-1-ylpyridin-1-ium-3-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-N-(2,3-dimethylphenyl)-6-pyrrolidino-pyridin-1-ium-3-carboxamide Formula: C24H33N4O2+ MolecularWeight: 409.54442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(CC(=O)NC(C)(C)C)C(=O)C2=C[NH+]=C(C=C2)N3CCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(CC(=O)NC(C)(C)C)C(=O)C2=C[NH+]=C(C=C2)N3CCCC3)C

InChI

InChI=1S/C24H32N4O2/c1-17-9-8-10-20(18(17)2)28(16-22(29)26-24(3,4)5)23(30)19-11-12-21(25-15-19)27-13-6-7-14-27/h8-12,15H,6-7,13-14,16H2,1-5H3,(H,26,29)/p+1