5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C20H25N2OS+ MolecularWeight: 341.4903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=CC4=C(S3)CCC4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=CC4=C(S3)CCC4

InChI

InChI=1S/C20H24N2OS/c1-15-5-2-3-6-17(15)14-21-9-11-22(12-10-21)20(23)19-13-16-7-4-8-18(16)24-19/h2-3,5-6,13H,4,7-12,14H2,1H3/p+1