7-(4-chlorophenyl)-2-naphthalen-1-ylsulfonyl-heptanoic acid

Systemtic Name: 7-(4-chlorophenyl)-2-naphthalen-1-ylsulfonyl-heptanoic acid Openeye Name: 7-(4-chlorophenyl)-2-(1-naphthylsulfonyl)heptanoic acid CAS Name: 7-(4-chlorophenyl)-2-(1-naphthalenylsulfonyl)heptanoic acid IUPAC Name: 7-(4-chlorophenyl)-2-naphthalen-1-ylsulfonylheptanoic acid Traditional Name: 7-(4-chlorophenyl)-2-(1-naphthylsulfonyl)enanthic acid Formula: C23H23ClO4S MolecularWeight: 430.94432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C(CCCCCC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C(CCCCCC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C23H23ClO4S/c24-19-15-13-17(14-16-19)7-2-1-3-11-22(23(25)26)29(27,28)21-12-6-9-18-8-4-5-10-20(18)21/h4-6,8-10,12-16,22H,1-3,7,11H2,(H,25,26)