4-(9H-fluoren-9-yl)-N-(2-thiophen-2-ylethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(9H-fluoren-9-yl)-N-(2-thiophen-2-ylethyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-(9H-fluoren-9-yl)-N-[2-(2-thienyl)ethyl]piperazin-4-ium-1-carboxamide CAS Name: 4-(9H-fluoren-9-yl)-N-(2-thiophen-2-ylethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-(9H-fluoren-9-yl)-N-(2-thiophen-2-ylethyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-(9H-fluoren-9-yl)-N-[2-(2-thienyl)ethyl]piperazin-4-ium-1-carboxamide Formula: C24H26N3OS+ MolecularWeight: 404.54774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)NCCC5=CC=CS5

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)NCCC5=CC=CS5

InChI

InChI=1S/C24H25N3OS/c28-24(25-12-11-18-6-5-17-29-18)27-15-13-26(14-16-27)23-21-9-3-1-7-19(21)20-8-2-4-10-22(20)23/h1-10,17,23H,11-16H2,(H,25,28)/p+1