2-[[2-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-methoxy-quinolin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[2-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-methoxy-quinolin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[2-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]-4-methoxy-quinoline-3-carbonyl]amino]acetic acid CAS Name: 2-[[[2-[2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]-4-methoxy-3-quinolinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[2-[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]-4-methoxyquinoline-3-carbonyl]amino]acetic acid Traditional Name: 2-[[2-[2-(4-carbethoxypiperazino)-2-keto-ethyl]-4-methoxy-quinoline-3-carbonyl]amino]acetic acid Formula: C22H26N4O7 MolecularWeight: 458.46444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC2=NC3=CC=CC=C3C(=C2C(=O)NCC(=O)O)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC2=NC3=CC=CC=C3C(=C2C(=O)NCC(=O)O)OC

InChI

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