3-[4-[(4-chlorophenyl)sulfonylamino]butyl]-4-propan-2-yl-azulene-1-sulfonic acid

Systemtic Name: 3-[4-[(4-chlorophenyl)sulfonylamino]butyl]-4-propan-2-yl-azulene-1-sulfonic acid Openeye Name: 3-[4-[(4-chlorophenyl)sulfonylamino]butyl]-4-isopropyl-azulene-1-sulfonic acid CAS Name: 3-[4-[(4-chlorophenyl)sulfonylamino]butyl]-4-propan-2-yl-1-azulenesulfonic acid IUPAC Name: 3-[4-[(4-chlorophenyl)sulfonylamino]butyl]-4-propan-2-ylazulene-1-sulfonic acid Traditional Name: 3-[4-[(4-chlorophenyl)sulfonylamino]butyl]-4-isopropyl-azulene-1-sulfonic acid Formula: C23H26ClNO5S2 MolecularWeight: 496.03924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C2C1=C(C=C2S(=O)(=O)O)CCCCNS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC=CC=C2C1=C(C=C2S(=O)(=O)O)CCCCNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H26ClNO5S2/c1-16(2)20-8-3-4-9-21-22(32(28,29)30)15-17(23(20)21)7-5-6-14-25-31(26,27)19-12-10-18(24)11-13-19/h3-4,8-13,15-16,25H,5-7,14H2,1-2H3,(H,28,29,30)