4-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]carbamoyl]quinolin-4-yl]oxybutanoic acid

Systemtic Name: 4-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]carbamoyl]quinolin-4-yl]oxybutanoic acid Openeye Name: 4-[[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]carbamoyl]-4-quinolyl]oxy]butanoic acid CAS Name: 4-[[2-[[[2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]amino]-oxomethyl]-4-quinolinyl]oxy]butanoic acid IUPAC Name: 4-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]carbamoyl]quinolin-4-yl]oxybutanoic acid Traditional Name: 4-[[2-[[2-(4-carbethoxypiperazino)-2-keto-ethyl]carbamoyl]-4-quinolyl]oxy]butyric acid Formula: C23H28N4O7 MolecularWeight: 472.49102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OCCCC(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OCCCC(=O)O

InChI

InChI=1S/C23H28N4O7/c1-2-33-23(32)27-11-9-26(10-12-27)20(28)15-24-22(31)18-14-19(34-13-5-8-21(29)30)16-6-3-4-7-17(16)25-18/h3-4,6-7,14H,2,5,8-13,15H2,1H3,(H,24,31)(H,29,30)