(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-(2-furylmethyl)-(2-thienylmethyl)ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-(2-furanylmethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-(furan-2-ylmethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-(2-furfuryl)-(2-thenyl)ammonium Formula: C22H22NO3S+ MolecularWeight: 380.47998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](CC3=CC=CO3)CC4=CC=CS4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](CC3=CC=CO3)CC4=CC=CS4

InChI

InChI=1S/C22H21NO3S/c1-2-16-7-8-20-17(12-22(24)26-21(20)11-16)13-23(14-18-5-3-9-25-18)15-19-6-4-10-27-19/h3-12H,2,13-15H2,1H3/p+1