4-chloranyl-2-naphthalen-2-yl-5-nitro-6-sulfamoyl-benzene-1,3-disulfonic acid

Systemtic Name: 4-chloranyl-2-naphthalen-2-yl-5-nitro-6-sulfamoyl-benzene-1,3-disulfonic acid Openeye Name: 4-chloro-2-(2-naphthyl)-5-nitro-6-sulfamoyl-benzene-1,3-disulfonic acid CAS Name: 4-chloro-2-(2-naphthalenyl)-5-nitro-6-sulfamoylbenzene-1,3-disulfonic acid IUPAC Name: 4-chloro-2-naphthalen-2-yl-5-nitro-6-sulfamoylbenzene-1,3-disulfonic acid Traditional Name: 4-chloro-2-(2-naphthyl)-5-nitro-6-sulfamoyl-benzene-1,3-disulfonic acid Formula: C16H11ClN2O10S3 MolecularWeight: 522.91394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=C(C(=C(C(=C3S(=O)(=O)O)Cl)[N+](=O)[O-])S(=O)(=O)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=C(C(=C(C(=C3S(=O)(=O)O)Cl)[N+](=O)[O-])S(=O)(=O)N)S(=O)(=O)O

InChI

InChI=1S/C16H11ClN2O10S3/c17-12-13(19(20)21)16(30(18,22)23)15(32(27,28)29)11(14(12)31(24,25)26)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,18,22,23)(H,24,25,26)(H,27,28,29)