4-[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-oxidanylidene-1H-quinolin-2-yl]carbonylamino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-oxidanylidene-1H-quinolin-2-yl]carbonylamino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid Openeye Name: 4-[[4-(1-ethoxycarbonylcyclobutoxy)-7-oxo-1H-quinoline-2-carbonyl]amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxo-pentanoic acid CAS Name: 4-[[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-oxo-1H-quinolin-2-yl]-oxomethyl]amino]-5-(4-ethoxycarbonyl-1-piperazinyl)-5-oxopentanoic acid IUPAC Name: 4-[[4-(1-ethoxycarbonylcyclobutyl)oxy-7-oxo-1H-quinoline-2-carbonyl]amino]-5-(4-ethoxycarbonylpiperazin-1-yl)-5-oxopentanoic acid Traditional Name: 4-[[4-(1-carbethoxycyclobutoxy)-7-keto-1H-quinoline-2-carbonyl]amino]-5-(4-carbethoxypiperazino)-5-keto-valeric acid Formula: C29H36N4O10 MolecularWeight: 600.61694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC1)OC2=C3C=CC(=O)C=C3NC(=C2)C(=O)NC(CCC(=O)O)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CCC1)OC2=C3C=CC(=O)C=C3NC(=C2)C(=O)NC(CCC(=O)O)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C29H36N4O10/c1-3-41-27(39)29(10-5-11-29)43-23-17-22(30-21-16-18(34)6-7-19(21)23)25(37)31-20(8-9-24(35)36)26(38)32-12-14-33(15-13-32)28(40)42-4-2/h6-7,16-17,20,30H,3-5,8-15H2,1-2H3,(H,31,37)(H,35,36)