2-[5-bromanyl-1-methyl-1-(phenylmethyl)indol-1-ium-3-yl]-2-oxidanylidene-ethanamide

Systemtic Name: 2-[5-bromanyl-1-methyl-1-(phenylmethyl)indol-1-ium-3-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-(1-benzyl-5-bromo-1-methyl-indol-1-ium-3-yl)-2-oxo-acetamide CAS Name: 2-[5-bromo-1-methyl-1-(phenylmethyl)-3-indol-1-iumyl]-2-oxoacetamide IUPAC Name: 2-(1-benzyl-5-bromo-1-methylindol-1-ium-3-yl)-2-oxoacetamide Traditional Name: 2-(1-benzyl-5-bromo-1-methyl-indol-1-ium-3-yl)-2-keto-acetamide Formula: C18H16BrN2O2+ MolecularWeight: 372.23584

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C=C(C2=C1C=CC(=C2)Br)C(=O)C(=O)N)CC3=CC=CC=C3

Isomeric SMILES

C[N+]1(C=C(C2=C1C=CC(=C2)Br)C(=O)C(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C18H15BrN2O2/c1-21(10-12-5-3-2-4-6-12)11-15(17(22)18(20)23)14-9-13(19)7-8-16(14)21/h2-9,11H,10H2,1H3,(H-,20,23)/p+1