3-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-3-azaspiro[4.5]decane-2,4-dione

Systemtic Name: 3-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-3-azaspiro[4.5]decane-2,4-dione Openeye Name: 3-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]-3-azaspiro[4.5]decane-2,4-dione CAS Name: 3-[[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]methyl]-3-azaspiro[4.5]decane-2,4-dione IUPAC Name: 3-[(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-3-azaspiro[4.5]decane-2,4-dione Traditional Name: 3-[[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]methyl]-3-azaspiro[4.5]decane-2,4-quinone Formula: C24H30N3O4S+ MolecularWeight: 456.5777

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC(=O)N(C2=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC2(CC1)CC(=O)N(C2=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H29N3O4S/c28-22-17-24(10-4-1-5-11-24)23(29)27(22)18-25-12-14-26(15-13-25)32(30,31)21-9-8-19-6-2-3-7-20(19)16-21/h2-3,6-9,16H,1,4-5,10-15,17-18H2/p+1