2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N,N-di(propan-2-yl)ethanamide

Systemtic Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N,N-di(propan-2-yl)ethanamide Openeye Name: N,N-diisopropyl-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-N,N-di(propan-2-yl)acetamide IUPAC Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N,N-di(propan-2-yl)acetamide Traditional Name: N,N-diisopropyl-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C22H32N3O3S+ MolecularWeight: 418.57278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H31N3O3S/c1-17(2)25(18(3)4)22(26)16-23-11-13-24(14-12-23)29(27,28)21-10-9-19-7-5-6-8-20(19)15-21/h5-10,15,17-18H,11-14,16H2,1-4H3/p+1