4-chloranyl-3-nitro-benzenesulfonyl chloride; 1,2,3,4-tetrahydroquinoline

Systemtic Name: 4-chloranyl-3-nitro-benzenesulfonyl chloride; 1,2,3,4-tetrahydroquinoline Openeye Name: 4-chloro-3-nitro-benzenesulfonyl chloride; 1,2,3,4-tetrahydroquinoline CAS Name: 4-chloro-3-nitrobenzenesulfonyl chloride; 1,2,3,4-tetrahydroquinoline IUPAC Name: 4-chloro-3-nitrobenzenesulfonyl chloride; 1,2,3,4-tetrahydroquinoline Traditional Name: 4-chloro-3-nitro-benzenesulfonyl chloride; 1,2,3,4-tetrahydroquinoline Formula: C15H14Cl2N2O4S MolecularWeight: 389.25366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC1.C1=CC(=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC2=CC=CC=C2NC1.C1=CC(=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C9H11N.C6H3Cl2NO4S/c1-2-6-9-8(4-1)5-3-7-10-9;7-5-2-1-4(14(8,12)13)3-6(5)9(10)11/h1-2,4,6,10H,3,5,7H2;1-3H