4-[[(3-methoxyphenyl)azaniumyl]methyl]-7-methyl-2-oxidanylidene-chromen-6-olate

Systemtic Name: 4-[[(3-methoxyphenyl)azaniumyl]methyl]-7-methyl-2-oxidanylidene-chromen-6-olate Openeye Name: 4-[[(3-methoxyphenyl)ammonio]methyl]-7-methyl-2-oxo-chromen-6-olate CAS Name: 4-[[(3-methoxyphenyl)ammonio]methyl]-7-methyl-2-oxo-1-benzopyran-6-olate IUPAC Name: 4-[[(3-methoxyphenyl)azaniumyl]methyl]-7-methyl-2-oxochromen-6-olate Traditional Name: 2-keto-4-[[(3-methoxyphenyl)ammonio]methyl]-7-methyl-chromen-6-olate Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C3=CC(=CC=C3)OC)[O-]

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C3=CC(=CC=C3)OC)[O-]

InChI

InChI=1S/C18H17NO4/c1-11-6-17-15(9-16(11)20)12(7-18(21)23-17)10-19-13-4-3-5-14(8-13)22-2/h3-9,19-20H,10H2,1-2H3