4-oxidanylidene-3-[(phenethylazaniumyl)methyl]chromen-2-olate

Systemtic Name: 4-oxidanylidene-3-[(phenethylazaniumyl)methyl]chromen-2-olate Openeye Name: 4-oxo-3-[(phenethylammonio)methyl]chromen-2-olate CAS Name: 4-oxo-3-[(phenethylammonio)methyl]-1-benzopyran-2-olate IUPAC Name: 4-oxo-3-[(phenethylazaniumyl)methyl]chromen-2-olate Traditional Name: 4-keto-3-[(phenethylammonio)methyl]chromen-2-olate Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH2+]CC2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC[NH2+]CC2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C18H17NO3/c20-17-14-8-4-5-9-16(14)22-18(21)15(17)12-19-11-10-13-6-2-1-3-7-13/h1-9,19,21H,10-12H2