4-(4-ethoxycarbonylpiperazin-1-yl)-3-[(4-methoxyquinolin-2-yl)carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-ethoxycarbonylpiperazin-1-yl)-3-[(4-methoxyquinolin-2-yl)carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-ethoxycarbonylpiperazin-1-yl)-3-[(4-methoxyquinoline-2-carbonyl)amino]-4-oxo-butanoic acid CAS Name: 4-(4-ethoxycarbonyl-1-piperazinyl)-3-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-(4-ethoxycarbonylpiperazin-1-yl)-3-[(4-methoxyquinoline-2-carbonyl)amino]-4-oxobutanoic acid Traditional Name: 4-(4-carbethoxypiperazino)-4-keto-3-[(4-methoxyquinoline-2-carbonyl)amino]butyric acid Formula: C22H26N4O7 MolecularWeight: 458.46444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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