8-[[[1,1-bis(oxidanylidene)thiolan-3-yl]azaniumyl]methyl]-6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 8-[[[1,1-bis(oxidanylidene)thiolan-3-yl]azaniumyl]methyl]-6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-olate Openeye Name: 6-chloro-8-[[(1,1-dioxothiolan-3-yl)ammonio]methyl]-4-methyl-2-oxo-chromen-7-olate CAS Name: 6-chloro-8-[[(1,1-dioxo-3-thiolanyl)ammonio]methyl]-4-methyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 6-chloro-8-[[(1,1-dioxothiolan-3-yl)azaniumyl]methyl]-4-methyl-2-oxochromen-7-olate Traditional Name: 6-chloro-8-[[(1,1-diketothiolan-3-yl)ammonio]methyl]-2-keto-4-methyl-chromen-7-olate Formula: C15H16ClNO5S MolecularWeight: 357.80924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CCS(=O)(=O)C3

InChI

InChI=1S/C15H16ClNO5S/c1-8-4-13(18)22-15-10(8)5-12(16)14(19)11(15)6-17-9-2-3-23(20,21)7-9/h4-5,9,17,19H,2-3,6-7H2,1H3