8-(7-chloranylquinolin-4-yl)naphthalene-1,3,5-trisulfonic acid

Systemtic Name: 8-(7-chloranylquinolin-4-yl)naphthalene-1,3,5-trisulfonic acid Openeye Name: 8-(7-chloro-4-quinolyl)naphthalene-1,3,5-trisulfonic acid CAS Name: 8-(7-chloro-4-quinolinyl)naphthalene-1,3,5-trisulfonic acid IUPAC Name: 8-(7-chloroquinolin-4-yl)naphthalene-1,3,5-trisulfonic acid Traditional Name: 8-(7-chloro-4-quinolyl)naphthalene-1,3,5-trisulfonic acid Formula: C19H12ClNO9S3 MolecularWeight: 529.94788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2C=C1Cl)C3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=CN=C2C=C1Cl)C3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C19H12ClNO9S3/c20-10-1-2-13-12(5-6-21-16(13)7-10)14-3-4-17(32(25,26)27)15-8-11(31(22,23)24)9-18(19(14)15)33(28,29)30/h1-9H,(H,22,23,24)(H,25,26,27)(H,28,29,30)