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

Systemtic Name: 8-(1H-imidazol-2-ylmethyl)-4-phenethyl-2-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 2-benzyl-8-(1H-imidazol-2-ylmethyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-(1H-imidazol-2-ylmethyl)-4-phenethyl-2-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 2-benzyl-8-(1H-imidazol-2-ylmethyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 2-benzyl-8-(1H-imidazol-2-ylmethyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C26H30N5O2+ MolecularWeight: 444.5487

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CC=CC=C4)CC5=NC=CN5

Isomeric SMILES

C1C[NH+](CCC12C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CC=CC=C4)CC5=NC=CN5

InChI

InChI=1S/C26H29N5O2/c32-24-26(12-17-29(18-13-26)20-23-27-14-15-28-23)31(16-11-21-7-3-1-4-8-21)25(33)30(24)19-22-9-5-2-6-10-22/h1-10,14-15H,11-13,16-20H2,(H,27,28)/p+1