(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[2-(2-methylphenoxy)ethyl]azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[2-(2-methylphenoxy)ethyl]azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-methyl-[2-(2-methylphenoxy)ethyl]ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-methyl-[2-(2-methylphenoxy)ethyl]ammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-methyl-[2-(2-methylphenoxy)ethyl]azanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-methyl-[2-(2-methylphenoxy)ethyl]ammonium Formula: C22H26NO3+ MolecularWeight: 352.44674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=CC=C3C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=CC=C3C

InChI

InChI=1S/C22H25NO3/c1-4-17-9-10-19-18(14-22(24)26-21(19)13-17)15-23(3)11-12-25-20-8-6-5-7-16(20)2/h5-10,13-14H,4,11-12,15H2,1-3H3/p+1