N-tert-butyl-2-[4-(1,2-dihydroacenaphthylen-5-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-(1,2-dihydroacenaphthylen-5-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-(1,2-dihydroacenaphthylene-5-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[1,2-dihydroacenaphthylen-5-yl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-(1,2-dihydroacenaphthylene-5-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(acenaphthene-5-carbonyl)piperazin-1-ium-1-yl]-N-tert-butyl-acetamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=C3C=CC=C4C3=C(CC4)C=C2

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=C3C=CC=C4C3=C(CC4)C=C2

InChI

InChI=1S/C23H29N3O2/c1-23(2,3)24-20(27)15-25-11-13-26(14-12-25)22(28)19-10-9-17-8-7-16-5-4-6-18(19)21(16)17/h4-6,9-10H,7-8,11-15H2,1-3H3,(H,24,27)/p+1