5-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-4-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxopentanoic acid Traditional Name: 5-[4-(2-furoyl)piperazino]-5-keto-4-[(4-methoxyquinoline-2-carbonyl)amino]valeric acid Formula: C25H26N4O7 MolecularWeight: 494.49654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)O)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)O)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C25H26N4O7/c1-35-21-15-19(26-17-6-3-2-5-16(17)21)23(32)27-18(8-9-22(30)31)24(33)28-10-12-29(13-11-28)25(34)20-7-4-14-36-20/h2-7,14-15,18H,8-13H2,1H3,(H,27,32)(H,30,31)