2-azanyl-5-[(3-methyl-4-oxidanyl-naphthalen-1-yl)sulfonylamino]benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[(3-methyl-4-oxidanyl-naphthalen-1-yl)sulfonylamino]benzenesulfonic acid Openeye Name: 2-amino-5-[(4-hydroxy-3-methyl-1-naphthyl)sulfonylamino]benzenesulfonic acid CAS Name: 2-amino-5-[(4-hydroxy-3-methyl-1-naphthalenyl)sulfonylamino]benzenesulfonic acid IUPAC Name: 2-amino-5-[(4-hydroxy-3-methylnaphthalen-1-yl)sulfonylamino]benzenesulfonic acid Traditional Name: 2-amino-5-[(4-hydroxy-3-methyl-1-naphthyl)sulfonylamino]besylic acid Formula: C17H16N2O6S2 MolecularWeight: 408.44874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=C1)S(=O)(=O)NC3=CC(=C(C=C3)N)S(=O)(=O)O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=C1)S(=O)(=O)NC3=CC(=C(C=C3)N)S(=O)(=O)O)O

InChI

InChI=1S/C17H16N2O6S2/c1-10-8-15(12-4-2-3-5-13(12)17(10)20)26(21,22)19-11-6-7-14(18)16(9-11)27(23,24)25/h2-9,19-20H,18H2,1H3,(H,23,24,25)