4-[[2-oxidanylidene-2-[(4-sulfonaphthalen-1-yl)amino]ethanoyl]amino]naphthalene-1-sulfonic acid

Systemtic Name: 4-[[2-oxidanylidene-2-[(4-sulfonaphthalen-1-yl)amino]ethanoyl]amino]naphthalene-1-sulfonic acid Openeye Name: 4-[[2-oxo-2-[(4-sulfo-1-naphthyl)amino]acetyl]amino]naphthalene-1-sulfonic acid CAS Name: 4-[[1,2-dioxo-2-[(4-sulfo-1-naphthalenyl)amino]ethyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 4-[[2-oxo-2-[(4-sulfonaphthalen-1-yl)amino]acetyl]amino]naphthalene-1-sulfonic acid Traditional Name: 4-[[2-keto-2-[(4-sulfo-1-naphthyl)amino]acetyl]amino]naphthalene-1-sulfonic acid Formula: C22H16N2O8S2 MolecularWeight: 500.50104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)C(=O)NC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)C(=O)NC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O

InChI

InChI=1S/C22H16N2O8S2/c25-21(23-17-9-11-19(33(27,28)29)15-7-3-1-5-13(15)17)22(26)24-18-10-12-20(34(30,31)32)16-8-4-2-6-14(16)18/h1-12H,(H,23,25)(H,24,26)(H,27,28,29)(H,30,31,32)