4-oxidanylidene-3-(2-phenylethynyl)chromen-2-olate; triethyl(methyl)azanium

Systemtic Name: 4-oxidanylidene-3-(2-phenylethynyl)chromen-2-olate; triethyl(methyl)azanium Openeye Name: 4-oxo-3-(2-phenylethynyl)chromen-2-olate; triethyl(methyl)ammonium CAS Name: 4-oxo-3-(2-phenylethynyl)-1-benzopyran-2-olate; triethyl(methyl)ammonium IUPAC Name: 4-oxo-3-(2-phenylethynyl)chromen-2-olate; triethyl(methyl)azanium Traditional Name: 4-keto-3-(2-phenylethynyl)chromen-2-olate; triethyl(methyl)ammonium Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CC.C1=CC=C(C=C1)C#CC2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

CC[N+](C)(CC)CC.C1=CC=C(C=C1)C#CC2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C17H10O3.C7H18N/c18-16-13-8-4-5-9-15(13)20-17(19)14(16)11-10-12-6-2-1-3-7-12;1-5-8(4,6-2)7-3/h1-9,19H;5-7H2,1-4H3/q;+1/p-1