8-[(3,4-dimethylphenyl)amino]-2-(methylcarbamoyl)-2-oxidanyl-octanoic acid

Systemtic Name: 8-[(3,4-dimethylphenyl)amino]-2-(methylcarbamoyl)-2-oxidanyl-octanoic acid Openeye Name: 8-(3,4-dimethylanilino)-2-hydroxy-2-(methylcarbamoyl)octanoic acid CAS Name: 8-(3,4-dimethylanilino)-2-hydroxy-2-(methylcarbamoyl)octanoic acid IUPAC Name: 8-(3,4-dimethylanilino)-2-hydroxy-2-(methylcarbamoyl)octanoic acid Traditional Name: 8-(3,4-dimethylanilino)-2-hydroxy-2-(methylcarbamoyl)caprylic acid Formula: C18H28N2O4 MolecularWeight: 336.42592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCCCCCCC(C(=O)NC)(C(=O)O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NCCCCCCC(C(=O)NC)(C(=O)O)O)C

InChI

InChI=1S/C18H28N2O4/c1-13-8-9-15(12-14(13)2)20-11-7-5-4-6-10-18(24,17(22)23)16(21)19-3/h8-9,12,20,24H,4-7,10-11H2,1-3H3,(H,19,21)(H,22,23)