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

Systemtic Name: 4-methyl-2-phenethyl-8-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 4-methyl-2-phenethyl-8-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 4-methyl-2-phenethyl-8-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 4-methyl-2-phenethyl-8-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 4-methyl-2-phenethyl-8-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-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:

CN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CC=CN3C4=CN=CC=C4)CCC5=CC=CC=C5

Isomeric SMILES

CN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CC=CN3C4=CN=CC=C4)CCC5=CC=CC=C5

InChI

InChI=1S/C26H29N5O2/c1-28-25(33)31(16-11-21-7-3-2-4-8-21)24(32)26(28)12-17-29(18-13-26)20-23-10-6-15-30(23)22-9-5-14-27-19-22/h2-10,14-15,19H,11-13,16-18,20H2,1H3/p+1