[4-(6-cyclopentyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl-(furan-3-ylmethyl)-methyl-azanium

Systemtic Name: [4-(6-cyclopentyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl-(furan-3-ylmethyl)-methyl-azanium Openeye Name: [4-(6-cyclopentyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl-(3-furylmethyl)-methyl-ammonium CAS Name: [4-(6-cyclopentyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl-(3-furanylmethyl)-methylammonium IUPAC Name: [4-(6-cyclopentyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl-(furan-3-ylmethyl)-methylazanium Traditional Name: [4-(6-cyclopentyl-4-keto-1H-pyrimidin-2-yl)benzyl]-(3-furfuryl)-methyl-ammonium Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3CCCC3)CC4=COC=C4

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3CCCC3)CC4=COC=C4

InChI

InChI=1S/C22H25N3O2/c1-25(14-17-10-11-27-15-17)13-16-6-8-19(9-7-16)22-23-20(12-21(26)24-22)18-4-2-3-5-18/h6-12,15,18H,2-5,13-14H2,1H3,(H,23,24,26)/p+1