4-[(7-chloranylquinolin-4-yl)amino]-2-nitro-benzenesulfonic acid

Systemtic Name: 4-[(7-chloranylquinolin-4-yl)amino]-2-nitro-benzenesulfonic acid Openeye Name: 4-[(7-chloro-4-quinolyl)amino]-2-nitro-benzenesulfonic acid CAS Name: 4-[(7-chloro-4-quinolinyl)amino]-2-nitrobenzenesulfonic acid IUPAC Name: 4-[(7-chloroquinolin-4-yl)amino]-2-nitrobenzenesulfonic acid Traditional Name: 4-[(7-chloro-4-quinolyl)amino]-2-nitro-besylic acid Formula: C15H10ClN3O5S MolecularWeight: 379.775

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C3C=CC(=CC3=NC=C2)Cl)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1NC2=C3C=CC(=CC3=NC=C2)Cl)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C15H10ClN3O5S/c16-9-1-3-11-12(5-6-17-13(11)7-9)18-10-2-4-15(25(22,23)24)14(8-10)19(20)21/h1-8H,(H,17,18)(H,22,23,24)