8-[(4-phenylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-dione

Systemtic Name: 8-[(4-phenylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-dione Openeye Name: 8-[(4-phenylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-dione CAS Name: 8-[(4-phenyl-1-piperazin-1-iumyl)methyl]-8-azaspiro[4.4]nonane-7,9-dione IUPAC Name: 8-[(4-phenylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-dione Traditional Name: 8-[(4-phenylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-quinone Formula: C19H26N3O2+ MolecularWeight: 328.42864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC(=O)N(C2=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2(C1)CC(=O)N(C2=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H25N3O2/c23-17-14-19(8-4-5-9-19)18(24)22(17)15-20-10-12-21(13-11-20)16-6-2-1-3-7-16/h1-3,6-7H,4-5,8-15H2/p+1