1-(5-methylthiophen-2-yl)-2-[5-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanone

Systemtic Name: 1-(5-methylthiophen-2-yl)-2-[5-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanone Openeye Name: 2-(5-benzyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(5-methyl-2-thienyl)ethanone CAS Name: 1-(5-methyl-2-thiophenyl)-2-[5-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-1-yl]ethanone IUPAC Name: 2-(5-benzyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-1-(5-methylthiophen-2-yl)ethanone Traditional Name: 2-(2-benzyl-1-pyrrolin-1-ium-1-yl)-1-(5-methyl-2-thienyl)ethanone Formula: C18H20NOS+ MolecularWeight: 298.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)C[N+]2=C(CCC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C(=O)C[N+]2=C(CCC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H20NOS/c1-14-9-10-18(21-14)17(20)13-19-11-5-8-16(19)12-15-6-3-2-4-7-15/h2-4,6-7,9-10H,5,8,11-13H2,1H3/q+1