2-[4-[2-(3-aminocarbonyl-4-methoxy-quinolin-2-yl)-3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxidanylidene-propyl]imidazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(3-aminocarbonyl-4-methoxy-quinolin-2-yl)-3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxidanylidene-propyl]imidazol-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(3-carbamoyl-4-methoxy-2-quinolyl)-3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxo-propyl]imidazol-1-yl]acetic acid CAS Name: 2-[4-[2-(3-carbamoyl-4-methoxy-2-quinolinyl)-3-(4-ethoxycarbonyl-1-piperazinyl)-3-oxopropyl]-1-imidazolyl]acetic acid IUPAC Name: 2-[4-[2-(3-carbamoyl-4-methoxyquinolin-2-yl)-3-(4-ethoxycarbonylpiperazin-1-yl)-3-oxopropyl]imidazol-1-yl]acetic acid Traditional Name: 2-[4-[2-(3-carbamoyl-4-methoxy-2-quinolyl)-3-(4-carbethoxypiperazino)-3-keto-propyl]imidazol-1-yl]acetic acid Formula: C26H30N6O7 MolecularWeight: 538.5524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CC2=CN(C=N2)CC(=O)O)C3=NC4=CC=CC=C4C(=C3C(=O)N)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CC2=CN(C=N2)CC(=O)O)C3=NC4=CC=CC=C4C(=C3C(=O)N)OC

InChI

InChI=1S/C26H30N6O7/c1-3-39-26(37)32-10-8-31(9-11-32)25(36)18(12-16-13-30(15-28-16)14-20(33)34)22-21(24(27)35)23(38-2)17-6-4-5-7-19(17)29-22/h4-7,13,15,18H,3,8-12,14H2,1-2H3,(H2,27,35)(H,33,34)