2-(furan-2-ylmethylsulfanyl)ethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)ethyl-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: 2-(2-furylmethylsulfanyl)ethyl-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: 2-(2-furanylmethylthio)ethyl-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: 2-(furan-2-ylmethylsulfanyl)ethyl-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: 2-(2-furfurylthio)ethyl-[(2-keto-7-methoxy-chromen-4-yl)methyl]ammonium Formula: C18H20NO4S+ MolecularWeight: 346.4207

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCSCC3=CC=CO3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCSCC3=CC=CO3

InChI

InChI=1S/C18H19NO4S/c1-21-14-4-5-16-13(9-18(20)23-17(16)10-14)11-19-6-8-24-12-15-3-2-7-22-15/h2-5,7,9-10,19H,6,8,11-12H2,1H3/p+1