3-[(3-azanyl-4-naphthalen-2-ylsulfonyl-phenyl)sulfonylamino]-4-methoxy-benzenesulfonic acid

Systemtic Name: 3-[(3-azanyl-4-naphthalen-2-ylsulfonyl-phenyl)sulfonylamino]-4-methoxy-benzenesulfonic acid Openeye Name: 3-[[3-amino-4-(2-naphthylsulfonyl)phenyl]sulfonylamino]-4-methoxy-benzenesulfonic acid CAS Name: 3-[[3-amino-4-(2-naphthalenylsulfonyl)phenyl]sulfonylamino]-4-methoxybenzenesulfonic acid IUPAC Name: 3-[(3-amino-4-naphthalen-2-ylsulfonylphenyl)sulfonylamino]-4-methoxybenzenesulfonic acid Traditional Name: 3-[[3-amino-4-(2-naphthylsulfonyl)phenyl]sulfonylamino]-4-methoxy-besylic acid Formula: C23H20N2O8S3 MolecularWeight: 548.6085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)N

InChI

InChI=1S/C23H20N2O8S3/c1-33-22-10-8-19(36(30,31)32)14-21(22)25-35(28,29)18-9-11-23(20(24)13-18)34(26,27)17-7-6-15-4-2-3-5-16(15)12-17/h2-14,25H,24H2,1H3,(H,30,31,32)