2-[2-[3-(methylcarbamoyl)-8-(2-methylpropoxycarbonylamino)-4-oxidanyl-naphthalen-1-yl]oxyethylsulfanyl]ethanoic acid

Systemtic Name: 2-[2-[3-(methylcarbamoyl)-8-(2-methylpropoxycarbonylamino)-4-oxidanyl-naphthalen-1-yl]oxyethylsulfanyl]ethanoic acid Openeye Name: 2-[2-[[4-hydroxy-8-(isobutoxycarbonylamino)-3-(methylcarbamoyl)-1-naphthyl]oxy]ethylsulfanyl]acetic acid CAS Name: 2-[2-[[4-hydroxy-3-(methylcarbamoyl)-8-[[2-methylpropoxy(oxo)methyl]amino]-1-naphthalenyl]oxy]ethylthio]acetic acid IUPAC Name: 2-[2-[4-hydroxy-3-(methylcarbamoyl)-8-(2-methylpropoxycarbonylamino)naphthalen-1-yl]oxyethylsulfanyl]acetic acid Traditional Name: 2-[2-[4-hydroxy-8-(isobutoxycarbonylamino)-3-(methylcarbamoyl)-1-naphthoxy]ethylthio]acetic acid Formula: C21H26N2O7S MolecularWeight: 450.50534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)NC1=CC=CC2=C(C(=CC(=C21)OCCSCC(=O)O)C(=O)NC)O

Isomeric SMILES

CC(C)COC(=O)NC1=CC=CC2=C(C(=CC(=C21)OCCSCC(=O)O)C(=O)NC)O

InChI

InChI=1S/C21H26N2O7S/c1-12(2)10-30-21(28)23-15-6-4-5-13-18(15)16(29-7-8-31-11-17(24)25)9-14(19(13)26)20(27)22-3/h4-6,9,12,26H,7-8,10-11H2,1-3H3,(H,22,27)(H,23,28)(H,24,25)