N,N-diethyl-9-[1-(furan-3-ylmethyl)piperidin-4-yl]-5-oxidanyl-9H-xanthene-3-carboximidamide

Systemtic Name: N,N-diethyl-9-[1-(furan-3-ylmethyl)piperidin-4-yl]-5-oxidanyl-9H-xanthene-3-carboximidamide Openeye Name: N,N-diethyl-9-[1-(3-furylmethyl)-4-piperidyl]-5-hydroxy-9H-xanthene-3-carboxamidine CAS Name: N,N-diethyl-9-[1-(3-furanylmethyl)-4-piperidinyl]-5-hydroxy-9H-xanthene-3-carboximidamide IUPAC Name: N,N-diethyl-9-[1-(furan-3-ylmethyl)piperidin-4-yl]-5-hydroxy-9H-xanthene-3-carboximidamide Traditional Name: N,N-diethyl-9-[1-(3-furfuryl)-4-piperidyl]-5-hydroxy-9H-xanthene-3-carboxamidine Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=N)C1=CC2=C(C=C1)C(C3=C(O2)C(=CC=C3)O)C4CCN(CC4)CC5=COC=C5

Isomeric SMILES

CCN(CC)C(=N)C1=CC2=C(C=C1)C(C3=C(O2)C(=CC=C3)O)C4CCN(CC4)CC5=COC=C5

InChI

InChI=1S/C28H33N3O3/c1-3-31(4-2)28(29)21-8-9-22-25(16-21)34-27-23(6-5-7-24(27)32)26(22)20-10-13-30(14-11-20)17-19-12-15-33-18-19/h5-9,12,15-16,18,20,26,29,32H,3-4,10-11,13-14,17H2,1-2H3