5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(3-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C20H25N2OS+ MolecularWeight: 341.4903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(S3)CCC4

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(S3)CCC4

InChI

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