cyclopropyl-[(4-fluorophenyl)methyl]-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(7-methoxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(7-methoxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: cyclopropyl-(4-fluorobenzyl)-[(2-keto-7-methoxy-chromen-4-yl)methyl]ammonium Formula: C21H21FNO3+ MolecularWeight: 354.394743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](CC3=CC=C(C=C3)F)C4CC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](CC3=CC=C(C=C3)F)C4CC4

InChI

InChI=1S/C21H20FNO3/c1-25-18-8-9-19-15(10-21(24)26-20(19)11-18)13-23(17-6-7-17)12-14-2-4-16(22)5-3-14/h2-5,8-11,17H,6-7,12-13H2,1H3/p+1