6-azanyl-2-(2-hydroxyethyl)-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5-sulfonate

Systemtic Name: 6-azanyl-2-(2-hydroxyethyl)-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5-sulfonate Openeye Name: 6-amino-2-(2-hydroxyethyl)-1,3-dioxo-benzo[de]isoquinoline-5-sulfonate CAS Name: 6-amino-2-(2-hydroxyethyl)-1,3-dioxo-5-benzo[de]isoquinolinesulfonate IUPAC Name: 6-amino-2-(2-hydroxyethyl)-1,3-dioxobenzo[de]isoquinoline-5-sulfonate Traditional Name: 6-amino-2-(2-hydroxyethyl)-1,3-diketo-benzo[de]isoquinoline-5-sulfonate Formula: C14H11N2O6S- MolecularWeight: 335.31194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2N)S(=O)(=O)[O-])CCO

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC(=C2N)S(=O)(=O)[O-])CCO

InChI

InChI=1S/C14H12N2O6S/c15-12-7-2-1-3-8-11(7)9(6-10(12)23(20,21)22)14(19)16(4-5-17)13(8)18/h1-3,6,17H,4-5,15H2,(H,20,21,22)/p-1