4-[10-(phenylsulfinyl)decylamino]benzoic acid

Systemtic Name: 4-[10-(phenylsulfinyl)decylamino]benzoic acid Openeye Name: 4-[10-(benzenesulfinyl)decylamino]benzoic acid CAS Name: 4-[10-(benzenesulfinyl)decylamino]benzoic acid IUPAC Name: 4-[10-(benzenesulfinyl)decylamino]benzoic acid Traditional Name: 4-[10-(benzenesulfinyl)decylamino]benzoic acid Formula: C23H31NO3S MolecularWeight: 401.56214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)CCCCCCCCCCNC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)CCCCCCCCCCNC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C23H31NO3S/c25-23(26)20-14-16-21(17-15-20)24-18-10-5-3-1-2-4-6-11-19-28(27)22-12-8-7-9-13-22/h7-9,12-17,24H,1-6,10-11,18-19H2,(H,25,26)