4-butyl-6-chloranyl-8-[(dimethylazaniumyl)methyl]-2-oxidanylidene-chromen-7-olate

Systemtic Name: 4-butyl-6-chloranyl-8-[(dimethylazaniumyl)methyl]-2-oxidanylidene-chromen-7-olate Openeye Name: 4-butyl-6-chloro-8-[(dimethylammonio)methyl]-2-oxo-chromen-7-olate CAS Name: 4-butyl-6-chloro-8-[(dimethylammonio)methyl]-2-oxo-1-benzopyran-7-olate IUPAC Name: 4-butyl-6-chloro-8-[(dimethylazaniumyl)methyl]-2-oxochromen-7-olate Traditional Name: 4-butyl-6-chloro-8-[(dimethylammonio)methyl]-2-keto-chromen-7-olate Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH+](C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH+](C)C

InChI

InChI=1S/C16H20ClNO3/c1-4-5-6-10-7-14(19)21-16-11(10)8-13(17)15(20)12(16)9-18(2)3/h7-8,20H,4-6,9H2,1-3H3