3-azanyl-4-naphthalen-1-ylsulfonyl-benzenesulfonic acid

Systemtic Name: 3-azanyl-4-naphthalen-1-ylsulfonyl-benzenesulfonic acid Openeye Name: 3-amino-4-(1-naphthylsulfonyl)benzenesulfonic acid CAS Name: 3-amino-4-(1-naphthalenylsulfonyl)benzenesulfonic acid IUPAC Name: 3-amino-4-naphthalen-1-ylsulfonylbenzenesulfonic acid Traditional Name: 3-amino-4-(1-naphthylsulfonyl)besylic acid Formula: C16H13NO5S2 MolecularWeight: 363.40812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)O)N

InChI

InChI=1S/C16H13NO5S2/c17-14-10-12(24(20,21)22)8-9-16(14)23(18,19)15-7-3-5-11-4-1-2-6-13(11)15/h1-10H,17H2,(H,20,21,22)