2-[1,4-dimethyl-5-(phenylcarbonyl)-1-propyl-pyrrol-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1,4-dimethyl-5-(phenylcarbonyl)-1-propyl-pyrrol-1-ium-2-yl]ethanamide Openeye Name: 2-(5-benzoyl-1,4-dimethyl-1-propyl-pyrrol-1-ium-2-yl)acetamide CAS Name: 2-(5-benzoyl-1,4-dimethyl-1-propyl-2-pyrrol-1-iumyl)acetamide IUPAC Name: 2-(5-benzoyl-1,4-dimethyl-1-propylpyrrol-1-ium-2-yl)acetamide Traditional Name: 2-(5-benzoyl-1,4-dimethyl-1-propyl-pyrrol-1-ium-2-yl)acetamide Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(C(=CC(=C1C(=O)C2=CC=CC=C2)C)CC(=O)N)C

Isomeric SMILES

CCC[N+]1(C(=CC(=C1C(=O)C2=CC=CC=C2)C)CC(=O)N)C

InChI

InChI=1S/C18H22N2O2/c1-4-10-20(3)15(12-16(19)21)11-13(2)17(20)18(22)14-8-6-5-7-9-14/h5-9,11H,4,10,12H2,1-3H3,(H-,19,21)/p+1