2-[7-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ynyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanoic acid

Systemtic Name: 2-[7-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ynyl]-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]ethanoic acid Openeye Name: 2-[7-[6-(tert-butoxycarbonylamino)hex-1-ynyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetic acid CAS Name: 2-[7-[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hex-1-ynyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetic acid IUPAC Name: 2-[7-[6-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ynyl]-2-oxo-3,4-dihydro-1H-quinolin-3-yl]acetic acid Traditional Name: 2-[7-[6-(tert-butoxycarbonylamino)hex-1-ynyl]-2-keto-3,4-dihydro-1H-quinolin-3-yl]acetic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC#CC1=CC2=C(CC(C(=O)N2)CC(=O)O)C=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC#CC1=CC2=C(CC(C(=O)N2)CC(=O)O)C=C1

InChI

InChI=1S/C22H28N2O5/c1-22(2,3)29-21(28)23-11-7-5-4-6-8-15-9-10-16-13-17(14-19(25)26)20(27)24-18(16)12-15/h9-10,12,17H,4-5,7,11,13-14H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)