(4-methylpiperazin-4-ium-1-yl)-[(2R)-1-naphthalen-2-ylsulfonylpyrrolidin-2-yl]methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-[(2R)-1-naphthalen-2-ylsulfonylpyrrolidin-2-yl]methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-[(2R)-1-(2-naphthylsulfonyl)pyrrolidin-2-yl]methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-[(2R)-1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-[(2R)-1-naphthalen-2-ylsulfonylpyrrolidin-2-yl]methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[(2R)-1-(2-naphthylsulfonyl)pyrrolidin-2-yl]methanone Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2CCCN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)[C@H]2CCCN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H25N3O3S/c1-21-11-13-22(14-12-21)20(24)19-7-4-10-23(19)27(25,26)18-9-8-16-5-2-3-6-17(16)15-18/h2-3,5-6,8-9,15,19H,4,7,10-14H2,1H3/p+1/t19-/m1/s1