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

Systemtic Name: 8-(1-benzofuran-2-ylmethyl)-4-phenethyl-2-(pyridin-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-(benzofuran-2-ylmethyl)-4-phenethyl-2-(3-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-(2-benzofuranylmethyl)-4-phenethyl-2-(3-pyridinylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-(1-benzofuran-2-ylmethyl)-4-phenethyl-2-(pyridin-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-(benzofuran-2-ylmethyl)-4-phenethyl-2-(3-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C30H31N4O3+ MolecularWeight: 495.59214

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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=CC6=CC=CC=C6O5

Isomeric SMILES

C1C[NH+](CCC12C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CN=CC=C4)CC5=CC6=CC=CC=C6O5

InChI

InChI=1S/C30H30N4O3/c35-28-30(13-17-32(18-14-30)22-26-19-25-10-4-5-11-27(25)37-26)34(16-12-23-7-2-1-3-8-23)29(36)33(28)21-24-9-6-15-31-20-24/h1-11,15,19-20H,12-14,16-18,21-22H2/p+1