6-azanyl-2-methyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5-sulfonic acid

Systemtic Name: 6-azanyl-2-methyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5-sulfonic acid Openeye Name: 6-amino-2-methyl-1,3-dioxo-benzo[de]isoquinoline-5-sulfonic acid CAS Name: 6-amino-2-methyl-1,3-dioxo-5-benzo[de]isoquinolinesulfonic acid IUPAC Name: 6-amino-2-methyl-1,3-dioxobenzo[de]isoquinoline-5-sulfonic acid Traditional Name: 6-amino-1,3-diketo-2-methyl-benzo[de]isoquinoline-5-sulfonic acid Formula: C13H10N2O5S MolecularWeight: 306.2939

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC3=C2C(=CC(=C3N)S(=O)(=O)O)C1=O

Isomeric SMILES

CN1C(=O)C2=CC=CC3=C2C(=CC(=C3N)S(=O)(=O)O)C1=O

InChI

InChI=1S/C13H10N2O5S/c1-15-12(16)7-4-2-3-6-10(7)8(13(15)17)5-9(11(6)14)21(18,19)20/h2-5H,14H2,1H3,(H,18,19,20)