8-[(1,3-dimethylpyrazol-4-yl)methyl]-4-methyl-2-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-[(1,3-dimethylpyrazol-4-yl)methyl]-4-methyl-2-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-[(1,3-dimethylpyrazol-4-yl)methyl]-4-methyl-2-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-[(1,3-dimethyl-4-pyrazolyl)methyl]-4-methyl-2-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-[(1,3-dimethylpyrazol-4-yl)methyl]-4-methyl-2-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-[(1,3-dimethylpyrazol-4-yl)methyl]-4-methyl-2-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C22H30N5O2+ MolecularWeight: 396.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C[NH+]2CCC3(CC2)C(=O)N(C(=O)N3C)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C=C1C[NH+]2CCC3(CC2)C(=O)N(C(=O)N3C)CCC4=CC=CC=C4)C

InChI

InChI=1S/C22H29N5O2/c1-17-19(15-24(2)23-17)16-26-13-10-22(11-14-26)20(28)27(21(29)25(22)3)12-9-18-7-5-4-6-8-18/h4-8,15H,9-14,16H2,1-3H3/p+1