N-(4-tert-butylphenyl)-4-(9H-fluoren-9-yl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-4-(9H-fluoren-9-yl)piperazin-4-ium-1-carboxamide Openeye Name: N-(4-tert-butylphenyl)-4-(9H-fluoren-9-yl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-tert-butylphenyl)-4-(9H-fluoren-9-yl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-tert-butylphenyl)-4-(9H-fluoren-9-yl)piperazin-4-ium-1-carboxamide Traditional Name: N-(4-tert-butylphenyl)-4-(9H-fluoren-9-yl)piperazin-4-ium-1-carboxamide Formula: C28H32N3O+ MolecularWeight: 426.57318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C28H31N3O/c1-28(2,3)20-12-14-21(15-13-20)29-27(32)31-18-16-30(17-19-31)26-24-10-6-4-8-22(24)23-9-5-7-11-25(23)26/h4-15,26H,16-19H2,1-3H3,(H,29,32)/p+1