4-tert-butyl-N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-tert-butyl-N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 4-tert-butyl-N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-tert-butyl-N-[(1-methyl-2-pyrrolyl)methyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-tert-butyl-N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 4-tert-butyl-N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C24H36N3O2+ MolecularWeight: 398.56154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCC[NH+]2CCOCC2)CC3=CC=CN3C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCC[NH+]2CCOCC2)CC3=CC=CN3C

InChI

InChI=1S/C24H35N3O2/c1-24(2,3)21-10-8-20(9-11-21)23(28)27(19-22-7-5-12-25(22)4)14-6-13-26-15-17-29-18-16-26/h5,7-12H,6,13-19H2,1-4H3/p+1