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

Systemtic Name: 2-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]carbamoyl]quinolin-4-yl]oxypropanoic acid Openeye Name: 2-[[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]carbamoyl]-4-quinolyl]oxy]propanoic acid CAS Name: 2-[[2-[[[2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]amino]-oxomethyl]-4-quinolinyl]oxy]propanoic acid IUPAC Name: 2-[2-[[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]carbamoyl]quinolin-4-yl]oxypropanoic acid Traditional Name: 2-[[2-[[2-(4-carbethoxypiperazino)-2-keto-ethyl]carbamoyl]-4-quinolyl]oxy]propionic acid Formula: C22H26N4O7 MolecularWeight: 458.46444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O7/c1-3-32-22(31)26-10-8-25(9-11-26)19(27)13-23-20(28)17-12-18(33-14(2)21(29)30)15-6-4-5-7-16(15)24-17/h4-7,12,14H,3,8-11,13H2,1-2H3,(H,23,28)(H,29,30)