8-phenethyl-4-(phenylmethyl)-2-(pyridin-2-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-phenethyl-4-(phenylmethyl)-2-(pyridin-2-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 4-benzyl-8-phenethyl-2-(2-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-phenethyl-4-(phenylmethyl)-2-(2-pyridinylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 4-benzyl-8-phenethyl-2-(pyridin-2-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 4-benzyl-8-phenethyl-2-(2-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C28H31N4O2+ MolecularWeight: 455.57134

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12C(=O)N(C(=O)N2CC3=CC=CC=C3)CC4=CC=CC=N4)CCC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC12C(=O)N(C(=O)N2CC3=CC=CC=C3)CC4=CC=CC=N4)CCC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2/c33-26-28(15-19-30(20-16-28)18-14-23-9-3-1-4-10-23)32(21-24-11-5-2-6-12-24)27(34)31(26)22-25-13-7-8-17-29-25/h1-13,17H,14-16,18-22H2/p+1