(6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl-[(5-methylfuran-2-yl)methyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: (6-chloranyl-4-oxidanylidene-chromen-3-yl)methyl-[(5-methylfuran-2-yl)methyl]-(pyridin-2-ylmethyl)azanium Openeye Name: (6-chloro-4-oxo-chromen-3-yl)methyl-[(5-methyl-2-furyl)methyl]-(2-pyridylmethyl)ammonium CAS Name: (6-chloro-4-oxo-1-benzopyran-3-yl)methyl-[(5-methyl-2-furanyl)methyl]-(2-pyridinylmethyl)ammonium IUPAC Name: (6-chloro-4-oxochromen-3-yl)methyl-[(5-methylfuran-2-yl)methyl]-(pyridin-2-ylmethyl)azanium Traditional Name: (6-chloro-4-keto-chromen-3-yl)methyl-[(5-methyl-2-furyl)methyl]-(2-pyridylmethyl)ammonium Formula: C22H20ClN2O3+ MolecularWeight: 395.8588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+](CC2=CC=CC=N2)CC3=COC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(O1)C[NH+](CC2=CC=CC=N2)CC3=COC4=C(C3=O)C=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN2O3/c1-15-5-7-19(28-15)13-25(12-18-4-2-3-9-24-18)11-16-14-27-21-8-6-17(23)10-20(21)22(16)26/h2-10,14H,11-13H2,1H3/p+1