2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione

Systemtic Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione Openeye Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione CAS Name: 2-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione IUPAC Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione Traditional Name: 2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-quinone Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C(=O)N(C(=O)N2)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCCC2(CC1)C(=O)N(C(=O)N2)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H28N4O2/c25-18-20(10-6-1-2-7-11-20)21-19(26)24(18)16-22-12-14-23(15-13-22)17-8-4-3-5-9-17/h3-5,8-9H,1-2,6-7,10-16H2,(H,21,26)/p+1