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

Systemtic Name: 6-azanyl-1,3-bis(oxidanylidene)-2-(phenylmethyl)benzo[de]isoquinoline-5-sulfonic acid Openeye Name: 6-amino-2-benzyl-1,3-dioxo-benzo[de]isoquinoline-5-sulfonic acid CAS Name: 6-amino-1,3-dioxo-2-(phenylmethyl)-5-benzo[de]isoquinolinesulfonic acid IUPAC Name: 6-amino-2-benzyl-1,3-dioxobenzo[de]isoquinoline-5-sulfonic acid Traditional Name: 6-amino-2-benzyl-1,3-diketo-benzo[de]isoquinoline-5-sulfonic acid Formula: C19H14N2O5S MolecularWeight: 382.38986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)O)C2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)O)C2=O

InChI

InChI=1S/C19H14N2O5S/c20-17-12-7-4-8-13-16(12)14(9-15(17)27(24,25)26)19(23)21(18(13)22)10-11-5-2-1-3-6-11/h1-9H,10,20H2,(H,24,25,26)