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

Systemtic Name: 8-(furan-2-ylmethyl)-4-phenethyl-2-(pyridin-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-(2-furylmethyl)-4-phenethyl-2-(3-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-(2-furanylmethyl)-4-phenethyl-2-(3-pyridinylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-(furan-2-ylmethyl)-4-phenethyl-2-(pyridin-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-(2-furfuryl)-4-phenethyl-2-(3-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C26H29N4O3+ MolecularWeight: 445.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CN=CC=C4)CC5=CC=CO5

Isomeric SMILES

C1C[NH+](CCC12C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CN=CC=C4)CC5=CC=CO5

InChI

InChI=1S/C26H28N4O3/c31-24-26(11-15-28(16-12-26)20-23-9-5-17-33-23)30(14-10-21-6-2-1-3-7-21)25(32)29(24)19-22-8-4-13-27-18-22/h1-9,13,17-18H,10-12,14-16,19-20H2/p+1