[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]azanium

Systemtic Name: [(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]azanium Openeye Name: [(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-[(3-oxobenzo[f]chromen-1-yl)methyl]ammonium CAS Name: [(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-[(3-oxo-1-benzo[f][1]benzopyranyl)methyl]ammonium IUPAC Name: [(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-[(3-oxobenzo[f]chromen-1-yl)methyl]azanium Traditional Name: [(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-[(3-ketobenzo[f]chromen-1-yl)methyl]ammonium Formula: C25H28N2O3+2 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(C[NH2+]CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C5=CC=CO5

Isomeric SMILES

C1CC[NH+](CC1)[C@H](C[NH2+]CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C5=CC=CO5

InChI

InChI=1S/C25H26N2O3/c28-24-15-19(25-20-8-3-2-7-18(20)10-11-23(25)30-24)16-26-17-21(22-9-6-14-29-22)27-12-4-1-5-13-27/h2-3,6-11,14-15,21,26H,1,4-5,12-13,16-17H2/p+2/t21-/m1/s1